-ISIS- 04110308332D 41 44 0 0 0 0 0 0 0 0999 V2000 0.3777 -3.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3766 -4.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0914 -4.5860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8078 -4.1727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 -3.3422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0896 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0833 -5.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6667 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4958 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5167 -2.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5125 -2.1000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8625 -1.5667 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3083 -1.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3042 -1.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0208 -2.2958 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 3.0958 -2.6833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0375 -1.5625 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 1.0333 -0.7375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0333 -2.3875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2125 -1.5583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4357 -1.5479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0224 -2.2668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1995 -2.2678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0187 -0.8350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1983 -0.8433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2173 -0.1381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1863 0.5760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0099 0.5804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4218 -0.1255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2500 -0.1250 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 -2.6667 0.5917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6667 -0.8375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4292 -1.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4292 -3.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2542 -1.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2542 -3.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6625 -2.2917 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 6.4875 -2.2917 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 6.4833 -1.4667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4833 -3.1167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3125 -2.2917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20 25 2 0 0 0 0 5 10 1 0 0 0 0 24 21 2 0 0 0 0 2 3 1 0 0 0 0 21 22 1 0 0 0 0 10 11 1 6 0 0 0 22 23 2 0 0 0 0 23 20 1 0 0 0 0 5 6 2 0 0 0 0 11 12 1 0 0 0 0 24 25 1 0 0 0 0 6 1 1 0 0 0 0 25 26 1 0 0 0 0 11 13 1 0 0 0 0 26 27 2 0 0 0 0 1 2 2 0 0 0 0 27 28 1 0 0 0 0 13 14 2 0 0 0 0 28 29 2 0 0 0 0 29 24 1 0 0 0 0 3 7 1 0 0 0 0 29 30 1 0 0 0 0 13 15 1 0 0 0 0 30 31 1 0 0 0 0 3 4 2 0 0 0 0 30 32 1 0 0 0 0 11 16 1 1 0 0 0 15 33 1 0 0 0 0 7 8 1 0 0 0 0 15 34 1 0 0 0 0 12 17 1 0 0 0 0 33 35 1 0 0 0 0 34 36 1 0 0 0 0 17 18 2 0 0 0 0 35 37 1 0 0 0 0 36 37 1 0 0 0 0 7 9 2 0 0 0 0 37 38 1 0 0 0 0 17 19 2 0 0 0 0 38 39 2 0 0 0 0 4 5 1 0 0 0 0 38 40 2 0 0 0 0 17 20 1 0 0 0 0 38 41 1 0 0 0 0 M END $$$$ -ISIS- 04110308362D 38 40 0 0 0 0 0 0 0 0999 V2000 0.3777 -3.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3766 -4.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0914 -4.5860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8078 -4.1727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 -3.3422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0896 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0833 -5.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6667 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4958 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5167 -2.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5125 -2.1000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8625 -1.5667 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3083 -1.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3042 -1.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0208 -2.2958 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 3.0958 -2.6833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0375 -1.5625 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 1.0333 -0.7375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0333 -2.3875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2125 -1.5583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4357 -1.5479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0224 -2.2668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1995 -2.2678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0187 -0.8350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1983 -0.8433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4292 -1.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4292 -3.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2542 -1.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2542 -3.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6625 -2.2917 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 6.4875 -2.2917 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 -2.2625 -1.5458 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2667 -0.7208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0875 -1.5417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2667 -2.3708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4833 -1.4667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4833 -3.1167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3125 -2.2917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17 19 2 0 0 0 0 4 5 1 0 0 0 0 17 20 1 0 0 0 0 20 25 2 0 0 0 0 5 10 1 0 0 0 0 24 21 2 0 0 0 0 2 3 1 0 0 0 0 21 22 1 0 0 0 0 10 11 1 6 0 0 0 22 23 2 0 0 0 0 23 20 1 0 0 0 0 5 6 2 0 0 0 0 11 12 1 0 0 0 0 24 25 1 0 0 0 0 6 1 1 0 0 0 0 15 26 1 0 0 0 0 11 13 1 0 0 0 0 15 27 1 0 0 0 0 1 2 2 0 0 0 0 26 28 1 0 0 0 0 13 14 2 0 0 0 0 27 29 1 0 0 0 0 3 7 1 0 0 0 0 28 30 1 0 0 0 0 29 30 1 0 0 0 0 13 15 1 0 0 0 0 30 31 1 0 0 0 0 3 4 2 0 0 0 0 21 32 1 0 0 0 0 11 16 1 1 0 0 0 32 33 1 0 0 0 0 7 8 1 0 0 0 0 32 34 1 0 0 0 0 12 17 1 0 0 0 0 32 35 1 0 0 0 0 31 36 2 0 0 0 0 17 18 2 0 0 0 0 31 37 2 0 0 0 0 7 9 2 0 0 0 0 31 38 1 0 0 0 0 M END $$$$ -ISIS- 04110308372D 35 37 0 0 0 0 0 0 0 0999 V2000 0.3777 -3.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3766 -4.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0914 -4.5860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8078 -4.1727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 -3.3422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0896 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0833 -5.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6667 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4958 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5167 -2.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5125 -2.1000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8625 -1.5667 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3083 -1.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3042 -1.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0208 -2.2958 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 3.0958 -2.6833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0375 -1.5625 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 1.0333 -0.7375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0333 -2.3875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2125 -1.5583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4357 -1.5479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0224 -2.2668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1995 -2.2678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0187 -0.8350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1983 -0.8433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4292 -1.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4292 -3.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2542 -1.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2542 -3.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6625 -2.2917 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2625 -1.5458 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2667 -0.7208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0875 -1.5417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2667 -2.3708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4875 -2.2917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17 18 2 0 0 0 0 7 9 2 0 0 0 0 17 19 2 0 0 0 0 4 5 1 0 0 0 0 17 20 1 0 0 0 0 20 25 2 0 0 0 0 5 10 1 0 0 0 0 24 21 2 0 0 0 0 2 3 1 0 0 0 0 21 22 1 0 0 0 0 10 11 1 6 0 0 0 22 23 2 0 0 0 0 23 20 1 0 0 0 0 5 6 2 0 0 0 0 11 12 1 0 0 0 0 24 25 1 0 0 0 0 6 1 1 0 0 0 0 15 26 1 0 0 0 0 11 13 1 0 0 0 0 15 27 1 0 0 0 0 1 2 2 0 0 0 0 26 28 1 0 0 0 0 13 14 2 0 0 0 0 27 29 1 0 0 0 0 3 7 1 0 0 0 0 28 30 1 0 0 0 0 29 30 1 0 0 0 0 13 15 1 0 0 0 0 21 31 1 0 0 0 0 3 4 2 0 0 0 0 31 32 1 0 0 0 0 11 16 1 1 0 0 0 31 33 1 0 0 0 0 7 8 1 0 0 0 0 31 34 1 0 0 0 0 12 17 1 0 0 0 0 30 35 1 0 0 0 0 M END $$$$ -ISIS- 04110308382D 35 38 0 0 0 0 0 0 0 0999 V2000 0.3777 -3.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3766 -4.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0914 -4.5860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8078 -4.1727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 -3.3422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0896 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0833 -5.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6667 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4958 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5167 -2.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5125 -2.1000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8625 -1.5667 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3083 -1.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3042 -1.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0208 -2.2958 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 3.0958 -2.6833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0375 -1.5625 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 1.0333 -0.7375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0333 -2.3875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2125 -1.5583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0224 -2.2668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1995 -2.2678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1983 -0.8433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4292 -1.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4292 -3.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2542 -1.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2542 -3.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6625 -2.2917 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.4875 -2.2917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4357 -1.5479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.8382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4268 -0.1255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2490 -0.1213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6628 -0.8357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2537 -1.5455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17 18 2 0 0 0 0 7 9 2 0 0 0 0 17 19 2 0 0 0 0 4 5 1 0 0 0 0 17 20 1 0 0 0 0 20 23 2 0 0 0 0 5 10 1 0 0 0 0 30 21 1 0 0 0 0 2 3 1 0 0 0 0 21 22 2 0 0 0 0 22 20 1 0 0 0 0 10 11 1 6 0 0 0 31 23 1 0 0 0 0 5 6 2 0 0 0 0 15 24 1 0 0 0 0 11 12 1 0 0 0 0 15 25 1 0 0 0 0 6 1 1 0 0 0 0 24 26 1 0 0 0 0 11 13 1 0 0 0 0 25 27 1 0 0 0 0 1 2 2 0 0 0 0 26 28 1 0 0 0 0 27 28 1 0 0 0 0 13 14 2 0 0 0 0 28 29 1 0 0 0 0 3 7 1 0 0 0 0 13 15 1 0 0 0 0 30 31 1 0 0 0 0 3 4 2 0 0 0 0 31 32 2 0 0 0 0 11 16 1 1 0 0 0 32 33 1 0 0 0 0 7 8 1 0 0 0 0 33 34 2 0 0 0 0 12 17 1 0 0 0 0 34 35 1 0 0 0 0 35 30 2 0 0 0 0 M END $$$$ -ISIS- 04110309362D 43 46 0 0 0 0 0 0 0 0999 V2000 0.3777 -3.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3766 -4.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0914 -4.5860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8078 -4.1727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 -3.3422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0896 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0833 -5.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6667 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4958 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5167 -2.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5125 -2.1000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8625 -1.5667 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3083 -1.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3042 -1.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0958 -2.6833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0375 -1.5625 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 1.0333 -0.7375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0333 -2.3875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2125 -1.5583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1945 -0.8395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0224 -2.2668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1995 -2.2678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2125 -0.1208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2083 -2.9792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4417 -2.9792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4357 -1.5479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0193 -0.8314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4293 -0.1165 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2574 -0.1119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6738 -0.8284 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2621 -1.5495 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4750 -0.6083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2625 -1.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1042 -2.0958 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 4.5125 -1.3792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3375 -1.3792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5125 -2.8083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3375 -2.8083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7458 -2.0917 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 6.5708 -2.0917 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 6.5667 -1.2667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5667 -2.9167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3958 -2.0917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26 21 1 0 0 0 0 2 3 1 0 0 0 0 21 22 2 0 0 0 0 22 19 1 0 0 0 0 10 11 1 6 0 0 0 20 23 1 0 0 0 0 5 6 2 0 0 0 0 22 24 1 0 0 0 0 11 12 1 0 0 0 0 21 25 1 0 0 0 0 26 27 2 0 0 0 0 6 1 1 0 0 0 0 11 13 1 0 0 0 0 1 2 2 0 0 0 0 13 14 2 0 0 0 0 3 7 1 0 0 0 0 11 15 1 1 0 0 0 26 31 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 3 4 2 0 0 0 0 30 32 1 0 0 0 0 12 16 1 0 0 0 0 30 33 1 0 0 0 0 7 8 1 0 0 0 0 13 34 1 0 0 0 0 16 17 2 0 0 0 0 34 35 1 0 0 0 0 35 36 1 0 0 0 0 36 39 1 0 0 0 0 16 18 2 0 0 0 0 34 37 1 0 0 0 0 7 9 2 0 0 0 0 37 38 1 0 0 0 0 16 19 1 0 0 0 0 38 39 1 0 0 0 0 4 5 1 0 0 0 0 39 40 1 0 0 0 0 19 20 2 0 0 0 0 40 41 2 0 0 0 0 20 27 1 0 0 0 0 40 42 2 0 0 0 0 5 10 1 0 0 0 0 40 43 1 0 0 0 0 M END $$$$ -ISIS- 04110308392D 39 42 0 0 0 0 0 0 0 0999 V2000 0.3777 -3.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3766 -4.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0914 -4.5860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8078 -4.1727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 -3.3422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0896 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0833 -5.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6667 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4958 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5167 -2.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5125 -2.1000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8625 -1.5667 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3083 -1.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3042 -1.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0208 -2.2958 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 3.0958 -2.6833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0375 -1.5625 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 1.0333 -0.7375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0333 -2.3875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2125 -1.5583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0224 -2.2668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1995 -2.2678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1983 -0.8433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4292 -1.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4292 -3.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2542 -1.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2542 -3.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6625 -2.2917 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 6.4875 -2.2917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4357 -1.5479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.8382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4268 -0.1255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2490 -0.1213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6628 -0.8357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2537 -1.5455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8958 -1.5750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8958 -3.0042 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 7.6917 -3.2167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8917 -3.8292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4 5 1 0 0 0 0 17 20 1 0 0 0 0 20 23 2 0 0 0 0 5 10 1 0 0 0 0 30 21 1 0 0 0 0 2 3 1 0 0 0 0 21 22 2 0 0 0 0 22 20 1 0 0 0 0 10 11 1 6 0 0 0 31 23 1 0 0 0 0 5 6 2 0 0 0 0 15 24 1 0 0 0 0 11 12 1 0 0 0 0 15 25 1 0 0 0 0 6 1 1 0 0 0 0 24 26 1 0 0 0 0 11 13 1 0 0 0 0 25 27 1 0 0 0 0 1 2 2 0 0 0 0 26 28 1 0 0 0 0 27 28 1 0 0 0 0 13 14 2 0 0 0 0 28 29 1 0 0 0 0 3 7 1 0 0 0 0 13 15 1 0 0 0 0 30 31 1 0 0 0 0 3 4 2 0 0 0 0 31 32 2 0 0 0 0 11 16 1 1 0 0 0 32 33 1 0 0 0 0 7 8 1 0 0 0 0 33 34 2 0 0 0 0 12 17 1 0 0 0 0 34 35 1 0 0 0 0 35 30 2 0 0 0 0 29 36 2 0 0 0 0 17 18 2 0 0 0 0 29 37 1 0 0 0 0 7 9 2 0 0 0 0 37 38 1 0 0 0 0 17 19 2 0 0 0 0 37 39 1 0 0 0 0 M END $$$$ -ISIS- 04110309392D 36 39 0 0 0 0 0 0 0 0999 V2000 0.3777 -3.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3766 -4.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0914 -4.5860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8078 -4.1727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 -3.3422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0896 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0833 -5.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6667 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4958 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5167 -2.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5125 -2.1000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8625 -1.5667 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3083 -1.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3042 -1.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0958 -2.6833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0375 -1.5625 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 1.0333 -0.7375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0333 -2.3875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1042 -2.0958 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 4.5125 -1.3792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3375 -1.3792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5125 -2.8083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3375 -2.8083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7458 -2.0917 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2125 -1.5583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3750 -0.9708 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.1578 -0.1679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7413 0.4185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5453 0.2075 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.7625 -0.5955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1757 -1.1875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6375 0.0500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9625 -0.3833 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5500 -0.9667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3792 0.2042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5708 -2.0917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16 18 2 0 0 0 0 7 9 2 0 0 0 0 13 19 1 0 0 0 0 4 5 1 0 0 0 0 19 20 1 0 0 0 0 5 10 1 0 0 0 0 20 21 1 0 0 0 0 21 24 1 0 0 0 0 2 3 1 0 0 0 0 19 22 1 0 0 0 0 10 11 1 6 0 0 0 22 23 1 0 0 0 0 5 6 2 0 0 0 0 23 24 1 0 0 0 0 11 12 1 0 0 0 0 16 25 1 0 0 0 0 6 1 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 11 13 1 0 0 0 0 1 2 2 0 0 0 0 13 14 2 0 0 0 0 3 7 1 0 0 0 0 11 15 1 1 0 0 0 26 31 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 3 4 2 0 0 0 0 27 32 2 0 0 0 0 29 33 1 1 0 0 0 12 16 1 0 0 0 0 26 33 1 1 0 0 0 7 8 1 0 0 0 0 33 34 1 0 0 0 0 16 17 2 0 0 0 0 33 35 1 0 0 0 0 24 36 1 0 0 0 0 M END $$$$ -ISIS- 04110309152D 35 38 0 0 0 0 0 0 0 0999 V2000 0.3777 -3.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3766 -4.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0914 -4.5860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8078 -4.1727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 -3.3422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0896 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0833 -5.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6667 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4958 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5167 -2.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5125 -2.1000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8625 -1.5667 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3083 -1.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3042 -1.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0958 -2.6833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0375 -1.5625 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 1.0333 -0.7375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0333 -2.3875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2125 -1.5583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0208 -2.2958 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 4.4292 -1.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4292 -3.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2542 -1.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2458 -3.0042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6625 -2.2917 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4357 -1.5479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0224 -2.2668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1995 -2.2678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0187 -0.8350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1983 -0.8433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2173 -0.1381 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1863 0.5760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0099 0.5804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4218 -0.1255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4875 -2.2917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16 18 2 0 0 0 0 7 9 2 0 0 0 0 16 19 1 0 0 0 0 4 5 1 0 0 0 0 13 20 1 0 0 0 0 5 10 1 0 0 0 0 20 21 1 0 0 0 0 2 3 1 0 0 0 0 20 22 1 0 0 0 0 10 11 1 6 0 0 0 21 23 1 0 0 0 0 5 6 2 0 0 0 0 22 24 1 0 0 0 0 11 12 1 0 0 0 0 23 25 1 0 0 0 0 25 24 1 0 0 0 0 19 30 2 0 0 0 0 6 1 1 0 0 0 0 29 26 2 0 0 0 0 11 13 1 0 0 0 0 26 27 1 0 0 0 0 1 2 2 0 0 0 0 27 28 2 0 0 0 0 28 19 1 0 0 0 0 13 14 2 0 0 0 0 3 7 1 0 0 0 0 29 30 1 0 0 0 0 11 15 1 1 0 0 0 30 31 1 0 0 0 0 3 4 2 0 0 0 0 31 32 2 0 0 0 0 12 16 1 0 0 0 0 32 33 1 0 0 0 0 7 8 1 0 0 0 0 33 34 2 0 0 0 0 34 29 1 0 0 0 0 16 17 2 0 0 0 0 25 35 1 0 0 0 0 M END $$$$ -ISIS- 04110308422D 38 41 0 0 0 0 0 0 0 0999 V2000 0.3777 -3.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3766 -4.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0914 -4.5860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8078 -4.1727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 -3.3422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0896 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0833 -5.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6667 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4958 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5167 -2.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5125 -2.1000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8625 -1.5667 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3083 -1.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3042 -1.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0208 -2.2958 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 3.0958 -2.6833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0375 -1.5625 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 1.0333 -0.7375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0333 -2.3875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2125 -1.5583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0224 -2.2668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1995 -2.2678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1983 -0.8433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4292 -1.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4292 -3.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2542 -1.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2542 -3.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6625 -2.2917 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.4875 -2.2917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4357 -1.5479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.8382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4268 -0.1255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2490 -0.1213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6628 -0.8357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2537 -1.5455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8958 -1.5750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8958 -3.0042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6917 -3.2167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17 19 2 0 0 0 0 4 5 1 0 0 0 0 17 20 1 0 0 0 0 20 23 2 0 0 0 0 5 10 1 0 0 0 0 30 21 1 0 0 0 0 2 3 1 0 0 0 0 21 22 2 0 0 0 0 22 20 1 0 0 0 0 10 11 1 6 0 0 0 31 23 1 0 0 0 0 5 6 2 0 0 0 0 15 24 1 0 0 0 0 11 12 1 0 0 0 0 15 25 1 0 0 0 0 6 1 1 0 0 0 0 24 26 1 0 0 0 0 11 13 1 0 0 0 0 25 27 1 0 0 0 0 1 2 2 0 0 0 0 26 28 1 0 0 0 0 27 28 1 0 0 0 0 13 14 2 0 0 0 0 28 29 1 0 0 0 0 3 7 1 0 0 0 0 13 15 1 0 0 0 0 30 31 1 0 0 0 0 3 4 2 0 0 0 0 31 32 2 0 0 0 0 11 16 1 1 0 0 0 32 33 1 0 0 0 0 7 8 1 0 0 0 0 33 34 2 0 0 0 0 12 17 1 0 0 0 0 34 35 1 0 0 0 0 35 30 2 0 0 0 0 29 36 2 0 0 0 0 17 18 2 0 0 0 0 29 37 1 0 0 0 0 7 9 2 0 0 0 0 37 38 1 0 0 0 0 M END $$$$ -ISIS- 04110309162D 41 45 0 0 0 0 0 0 0 0999 V2000 0.3777 -3.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3766 -4.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0914 -4.5860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8078 -4.1727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 -3.3422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0896 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0833 -5.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6667 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4958 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5167 -2.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5125 -2.1000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8625 -1.5667 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3083 -1.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3042 -1.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0958 -2.6833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0375 -1.5625 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 1.0333 -0.7375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0333 -2.3875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0208 -2.2958 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 4.4292 -1.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4292 -3.0083 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.2458 -3.0042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2125 -1.5625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1981 -0.8457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0188 -2.2772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1959 -2.2740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4357 -1.5604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0221 -0.8471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.1344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2573 -0.1338 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6690 -0.8518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2557 -1.5616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2529 -1.5798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6625 -2.2917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4819 -2.2919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8926 -1.5810 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4780 -0.8685 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6600 -0.8718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0125 -3.7208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1875 -3.7208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2250 -4.5167 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 5 10 1 0 0 0 0 19 21 1 0 0 0 0 20 33 1 0 0 0 0 2 3 1 0 0 0 0 21 22 1 0 0 0 0 34 22 1 0 0 0 0 10 11 1 6 0 0 0 16 23 1 0 0 0 0 5 6 2 0 0 0 0 23 24 2 0 0 0 0 24 28 1 0 0 0 0 11 12 1 0 0 0 0 27 25 1 0 0 0 0 6 1 1 0 0 0 0 25 26 2 0 0 0 0 26 23 1 0 0 0 0 11 13 1 0 0 0 0 1 2 2 0 0 0 0 27 28 1 0 0 0 0 13 14 2 0 0 0 0 28 29 2 0 0 0 0 3 7 1 0 0 0 0 29 30 1 0 0 0 0 11 15 1 1 0 0 0 30 31 2 0 0 0 0 3 4 2 0 0 0 0 31 32 1 0 0 0 0 32 27 2 0 0 0 0 12 16 1 0 0 0 0 7 8 1 0 0 0 0 33 34 2 0 0 0 0 16 17 2 0 0 0 0 34 35 1 0 0 0 0 35 36 2 0 0 0 0 16 18 2 0 0 0 0 36 37 1 0 0 0 0 7 9 2 0 0 0 0 37 38 2 0 0 0 0 38 33 1 0 0 0 0 13 19 1 0 0 0 0 21 39 1 6 0 0 0 4 5 1 0 0 0 0 39 40 2 0 0 0 0 19 20 1 0 0 0 0 39 41 1 0 0 0 0 M CHG 1 41 -1 M END $$$$ -ISIS- 04110308422D 38 41 0 0 0 0 0 0 0 0999 V2000 0.3777 -3.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3766 -4.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0914 -4.5860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8078 -4.1727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 -3.3422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0896 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0833 -5.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6667 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4958 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5167 -2.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5125 -2.1000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8625 -1.5667 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3083 -1.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3042 -1.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0208 -2.2958 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 3.0958 -2.6833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0375 -1.5625 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 1.0333 -0.7375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0333 -2.3875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2125 -1.5583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0224 -2.2668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1995 -2.2678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1983 -0.8433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4292 -1.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4292 -3.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2542 -1.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2542 -3.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6625 -2.2917 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 6.4875 -2.2917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4357 -1.5479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.8382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4268 -0.1255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2490 -0.1213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6628 -0.8357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2537 -1.5455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8958 -1.5750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8958 -3.0042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6917 -3.2167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17 19 2 0 0 0 0 4 5 1 0 0 0 0 17 20 1 0 0 0 0 20 23 2 0 0 0 0 5 10 1 0 0 0 0 30 21 1 0 0 0 0 2 3 1 0 0 0 0 21 22 2 0 0 0 0 22 20 1 0 0 0 0 10 11 1 6 0 0 0 31 23 1 0 0 0 0 5 6 2 0 0 0 0 15 24 1 0 0 0 0 11 12 1 0 0 0 0 15 25 1 0 0 0 0 6 1 1 0 0 0 0 24 26 1 0 0 0 0 11 13 1 0 0 0 0 25 27 1 0 0 0 0 1 2 2 0 0 0 0 26 28 1 0 0 0 0 27 28 1 0 0 0 0 13 14 2 0 0 0 0 28 29 1 0 0 0 0 3 7 1 0 0 0 0 13 15 1 0 0 0 0 30 31 1 0 0 0 0 3 4 2 0 0 0 0 31 32 2 0 0 0 0 11 16 1 1 0 0 0 32 33 1 0 0 0 0 7 8 1 0 0 0 0 33 34 2 0 0 0 0 12 17 1 0 0 0 0 34 35 1 0 0 0 0 35 30 2 0 0 0 0 29 36 2 0 0 0 0 17 18 2 0 0 0 0 29 37 1 0 0 0 0 7 9 2 0 0 0 0 37 38 1 0 0 0 0 M END $$$$ -ISIS- 04110308432D 35 38 0 0 0 0 0 0 0 0999 V2000 0.3777 -3.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3766 -4.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0914 -4.5860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8078 -4.1727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 -3.3422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0896 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0833 -5.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6667 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4958 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5167 -2.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5125 -2.1000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8625 -1.5667 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3083 -1.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3042 -1.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0208 -2.2958 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 3.0958 -2.6833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0375 -1.5625 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 1.0333 -0.7375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0333 -2.3875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2125 -1.5583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0224 -2.2668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1995 -2.2678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1983 -0.8433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4292 -1.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4292 -3.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2542 -3.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4357 -1.5479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.8382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4268 -0.1255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2490 -0.1213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6628 -0.8357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2537 -1.5455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2250 -1.3625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9375 -1.7750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9333 -2.6000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17 18 2 0 0 0 0 7 9 2 0 0 0 0 17 19 2 0 0 0 0 4 5 1 0 0 0 0 17 20 1 0 0 0 0 20 23 2 0 0 0 0 5 10 1 0 0 0 0 27 21 1 0 0 0 0 2 3 1 0 0 0 0 21 22 2 0 0 0 0 22 20 1 0 0 0 0 10 11 1 6 0 0 0 28 23 1 0 0 0 0 5 6 2 0 0 0 0 15 24 1 0 0 0 0 11 12 1 0 0 0 0 15 25 1 0 0 0 0 6 1 1 0 0 0 0 25 26 1 0 0 0 0 11 13 1 0 0 0 0 1 2 2 0 0 0 0 27 28 1 0 0 0 0 13 14 2 0 0 0 0 28 29 2 0 0 0 0 3 7 1 0 0 0 0 29 30 1 0 0 0 0 13 15 1 0 0 0 0 30 31 2 0 0 0 0 3 4 2 0 0 0 0 31 32 1 0 0 0 0 32 27 2 0 0 0 0 11 16 1 1 0 0 0 24 33 1 0 0 0 0 7 8 1 0 0 0 0 33 34 1 0 0 0 0 12 17 1 0 0 0 0 34 35 1 0 0 0 0 35 26 1 0 0 0 0 M END $$$$ -ISIS- 04110308442D 37 40 0 0 0 0 0 0 0 0999 V2000 0.3777 -3.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3766 -4.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0914 -4.5860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8078 -4.1727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 -3.3422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0896 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0833 -5.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6667 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4958 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5167 -2.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5125 -2.1000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8625 -1.5667 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3083 -1.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3042 -1.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0208 -2.2958 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 3.0958 -2.6833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0375 -1.5625 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 1.0333 -0.7375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0333 -2.3875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2125 -1.5583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0224 -2.2668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1995 -2.2678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1983 -0.8433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4292 -1.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4292 -3.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4357 -1.5479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.8382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4268 -0.1255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2490 -0.1213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6628 -0.8357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2537 -1.5455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2542 -1.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2542 -3.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6625 -2.2917 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 6.4875 -2.2917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8958 -1.5750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8958 -3.0042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7 9 2 0 0 0 0 17 19 2 0 0 0 0 4 5 1 0 0 0 0 17 20 1 0 0 0 0 20 23 2 0 0 0 0 5 10 1 0 0 0 0 26 21 1 0 0 0 0 2 3 1 0 0 0 0 21 22 2 0 0 0 0 22 20 1 0 0 0 0 10 11 1 6 0 0 0 27 23 1 0 0 0 0 5 6 2 0 0 0 0 15 24 1 0 0 0 0 11 12 1 0 0 0 0 15 25 1 0 0 0 0 6 1 1 0 0 0 0 11 13 1 0 0 0 0 26 27 1 0 0 0 0 1 2 2 0 0 0 0 27 28 2 0 0 0 0 13 14 2 0 0 0 0 28 29 1 0 0 0 0 3 7 1 0 0 0 0 29 30 2 0 0 0 0 13 15 1 0 0 0 0 30 31 1 0 0 0 0 31 26 2 0 0 0 0 3 4 2 0 0 0 0 24 32 1 0 0 0 0 11 16 1 1 0 0 0 25 33 1 0 0 0 0 7 8 1 0 0 0 0 32 34 1 0 0 0 0 34 33 1 0 0 0 0 12 17 1 0 0 0 0 34 35 1 0 0 0 0 35 36 2 0 0 0 0 17 18 2 0 0 0 0 35 37 1 0 0 0 0 M END $$$$ -ISIS- 04110309402D 41 45 0 0 0 0 0 0 0 0999 V2000 0.2117 -1.5586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5028 -1.1460 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4952 -2.7940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2144 -2.3793 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3777 -3.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3766 -4.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0914 -4.5860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8078 -4.1727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 -3.3422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0896 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0833 -5.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6667 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4958 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5167 -2.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5125 -2.1000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8625 -1.5667 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3083 -1.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3042 -1.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0958 -2.6833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0375 -1.5625 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 1.0333 -0.7375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0333 -2.3875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1042 -2.0958 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 4.5125 -1.3792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3375 -1.3792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5125 -2.8083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3375 -2.8083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7458 -2.0917 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.5708 -2.0917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2144 -2.3833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2183 -1.5540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9345 -1.1451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9267 -2.8036 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6474 -2.3901 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6501 -1.5609 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3684 -1.1505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0845 -1.5680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0778 -2.4003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3589 -2.8070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9417 -0.3167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9333 -3.6250 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16 20 1 0 0 0 0 9 10 2 0 0 0 0 20 21 2 0 0 0 0 10 5 1 0 0 0 0 20 22 2 0 0 0 0 2 31 1 0 0 0 0 17 23 1 0 0 0 0 7 11 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 28 1 0 0 0 0 11 12 1 0 0 0 0 23 26 1 0 0 0 0 5 6 2 0 0 0 0 26 27 1 0 0 0 0 11 13 2 0 0 0 0 27 28 1 0 0 0 0 20 1 1 0 0 0 0 30 3 1 0 0 0 0 28 29 1 0 0 0 0 30 31 2 0 0 0 0 9 14 1 0 0 0 0 6 7 1 0 0 0 0 14 15 1 6 0 0 0 1 2 2 0 0 0 0 30 33 1 0 0 0 0 31 32 1 0 0 0 0 32 35 1 0 0 0 0 34 33 1 0 0 0 0 15 16 1 0 0 0 0 7 8 2 0 0 0 0 34 35 2 0 0 0 0 15 17 1 0 0 0 0 35 36 1 0 0 0 0 3 4 2 0 0 0 0 36 37 2 0 0 0 0 17 18 2 0 0 0 0 37 38 1 0 0 0 0 8 9 1 0 0 0 0 38 39 2 0 0 0 0 39 34 1 0 0 0 0 15 19 1 1 0 0 0 32 40 2 0 0 0 0 4 1 1 0 0 0 0 33 41 2 0 0 0 0 M END $$$$ -ISIS- 04110309402D 32 34 0 0 0 0 0 0 0 0999 V2000 0.3777 -3.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3766 -4.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0914 -4.5860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8078 -4.1727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 -3.3422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0896 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0833 -5.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6667 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4958 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5167 -2.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5125 -2.1000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8625 -1.5667 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3083 -1.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3042 -1.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0958 -2.6833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0375 -1.5625 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 1.0333 -0.7375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0333 -2.3875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1042 -2.0958 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 4.5125 -1.3792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3375 -1.3792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5125 -2.8083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3375 -2.8083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7458 -2.0917 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.5708 -2.0917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2125 -1.5583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1945 -0.8395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0187 -0.8350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4357 -1.5479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0224 -2.2668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1995 -2.2678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2625 -1.5417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12 16 1 0 0 0 0 7 8 1 0 0 0 0 16 17 2 0 0 0 0 16 18 2 0 0 0 0 7 9 2 0 0 0 0 13 19 1 0 0 0 0 4 5 1 0 0 0 0 19 20 1 0 0 0 0 5 10 1 0 0 0 0 20 21 1 0 0 0 0 21 24 1 0 0 0 0 2 3 1 0 0 0 0 19 22 1 0 0 0 0 10 11 1 6 0 0 0 22 23 1 0 0 0 0 5 6 2 0 0 0 0 23 24 1 0 0 0 0 11 12 1 0 0 0 0 24 25 1 0 0 0 0 6 1 1 0 0 0 0 16 26 1 0 0 0 0 11 13 1 0 0 0 0 26 27 2 0 0 0 0 1 2 2 0 0 0 0 27 28 1 0 0 0 0 13 14 2 0 0 0 0 28 29 2 0 0 0 0 3 7 1 0 0 0 0 29 30 1 0 0 0 0 11 15 1 1 0 0 0 30 31 2 0 0 0 0 31 26 1 0 0 0 0 3 4 2 0 0 0 0 29 32 1 0 0 0 0 M END $$$$ -ISIS- 04110309412D 39 41 0 0 0 0 0 0 0 0999 V2000 0.3777 -3.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3766 -4.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0914 -4.5860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8078 -4.1727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 -3.3422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0896 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0833 -5.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6667 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4958 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5167 -2.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5125 -2.1000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8625 -1.5667 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3083 -1.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3042 -1.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0958 -2.6833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0375 -1.5625 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 1.0333 -0.7375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0333 -2.3875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1042 -2.0958 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 4.5125 -1.3792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3375 -1.3792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5125 -2.8083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3375 -2.8083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7458 -2.0917 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 6.5708 -2.0917 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 0.2125 -1.5583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1945 -0.8395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0187 -0.8350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4357 -1.5479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0224 -2.2668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1995 -2.2678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2625 -1.5417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5667 -1.2667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5667 -2.9167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3958 -2.0917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2125 -0.1208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2083 -2.9792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4417 -2.9792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0875 -1.5375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4 5 1 0 0 0 0 19 20 1 0 0 0 0 5 10 1 0 0 0 0 20 21 1 0 0 0 0 21 24 1 0 0 0 0 2 3 1 0 0 0 0 19 22 1 0 0 0 0 10 11 1 6 0 0 0 22 23 1 0 0 0 0 5 6 2 0 0 0 0 23 24 1 0 0 0 0 11 12 1 0 0 0 0 24 25 1 0 0 0 0 6 1 1 0 0 0 0 16 26 1 0 0 0 0 11 13 1 0 0 0 0 26 27 2 0 0 0 0 1 2 2 0 0 0 0 27 28 1 0 0 0 0 13 14 2 0 0 0 0 28 29 2 0 0 0 0 3 7 1 0 0 0 0 29 30 1 0 0 0 0 11 15 1 1 0 0 0 30 31 2 0 0 0 0 31 26 1 0 0 0 0 3 4 2 0 0 0 0 29 32 1 0 0 0 0 12 16 1 0 0 0 0 25 33 2 0 0 0 0 7 8 1 0 0 0 0 25 34 2 0 0 0 0 16 17 2 0 0 0 0 25 35 1 0 0 0 0 27 36 1 0 0 0 0 16 18 2 0 0 0 0 31 37 1 0 0 0 0 7 9 2 0 0 0 0 30 38 1 0 0 0 0 13 19 1 0 0 0 0 32 39 1 0 0 0 0 M END $$$$ -ISIS- 04110309432D 40 43 0 0 0 0 0 0 0 0999 V2000 0.2117 -1.5586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5028 -1.1460 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4952 -2.7940 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2144 -2.3793 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3777 -3.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3766 -4.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0914 -4.5860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8078 -4.1727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 -3.3422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0896 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0833 -5.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6667 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4958 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5167 -2.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5125 -2.1000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8625 -1.5667 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3083 -1.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3042 -1.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0958 -2.6833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0375 -1.5625 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 1.0333 -0.7375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0333 -2.3875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1042 -2.0958 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 4.5125 -1.3792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3375 -1.3792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5125 -2.8083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3375 -2.8083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7458 -2.0917 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.5708 -2.0917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2144 -2.3833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2183 -1.5540 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9345 -1.1451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9267 -2.8036 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6474 -2.3901 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.6501 -1.5609 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5083 -0.3208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5000 -3.6167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4500 -2.6000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6542 -3.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7958 -2.9625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4 1 1 0 0 0 0 16 20 1 0 0 0 0 9 10 2 0 0 0 0 20 21 2 0 0 0 0 10 5 1 0 0 0 0 20 22 2 0 0 0 0 2 31 1 0 0 0 0 17 23 1 0 0 0 0 7 11 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 28 1 0 0 0 0 11 12 1 0 0 0 0 23 26 1 0 0 0 0 5 6 2 0 0 0 0 26 27 1 0 0 0 0 11 13 2 0 0 0 0 27 28 1 0 0 0 0 30 3 1 0 0 0 0 28 29 1 0 0 0 0 20 1 1 0 0 0 0 30 31 2 0 0 0 0 9 14 1 0 0 0 0 6 7 1 0 0 0 0 14 15 1 6 0 0 0 1 2 2 0 0 0 0 30 33 1 0 0 0 0 31 32 1 0 0 0 0 32 35 1 0 0 0 0 34 33 1 0 0 0 0 15 16 1 0 0 0 0 7 8 2 0 0 0 0 34 35 1 0 0 0 0 15 17 1 0 0 0 0 2 36 1 0 0 0 0 3 4 2 0 0 0 0 3 37 1 0 0 0 0 17 18 2 0 0 0 0 34 38 1 0 0 0 0 8 9 1 0 0 0 0 34 39 1 0 0 0 0 15 19 1 1 0 0 0 4 40 1 0 0 0 0 M END $$$$ -ISIS- 04110308452D 38 42 0 0 0 0 0 0 0 0999 V2000 0.3777 -3.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3766 -4.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0914 -4.5860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8078 -4.1727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 -3.3422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0896 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0833 -5.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6667 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4958 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5167 -2.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5125 -2.1000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8625 -1.5667 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3083 -1.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3042 -1.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0208 -2.2958 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 3.0958 -2.6833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0375 -1.5625 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 1.0333 -0.7375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0333 -2.3875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2125 -1.5583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0224 -2.2668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1995 -2.2678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1983 -0.8433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4292 -1.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4292 -3.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4357 -1.5479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.8382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4268 -0.1255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2490 -0.1213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6628 -0.8357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2537 -1.5455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2542 -3.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2529 -1.5798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6625 -2.2917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4819 -2.2919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8926 -1.5810 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4780 -0.8685 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6600 -0.8718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17 19 2 0 0 0 0 4 5 1 0 0 0 0 17 20 1 0 0 0 0 20 23 2 0 0 0 0 5 10 1 0 0 0 0 26 21 1 0 0 0 0 2 3 1 0 0 0 0 21 22 2 0 0 0 0 22 20 1 0 0 0 0 10 11 1 6 0 0 0 27 23 1 0 0 0 0 5 6 2 0 0 0 0 15 24 1 0 0 0 0 11 12 1 0 0 0 0 15 25 1 0 0 0 0 6 1 1 0 0 0 0 11 13 1 0 0 0 0 26 27 1 0 0 0 0 1 2 2 0 0 0 0 27 28 2 0 0 0 0 13 14 2 0 0 0 0 28 29 1 0 0 0 0 3 7 1 0 0 0 0 29 30 2 0 0 0 0 13 15 1 0 0 0 0 30 31 1 0 0 0 0 31 26 2 0 0 0 0 24 33 1 0 0 0 0 3 4 2 0 0 0 0 25 32 1 0 0 0 0 34 32 1 0 0 0 0 11 16 1 1 0 0 0 7 8 1 0 0 0 0 33 34 2 0 0 0 0 12 17 1 0 0 0 0 34 35 1 0 0 0 0 35 36 2 0 0 0 0 17 18 2 0 0 0 0 36 37 1 0 0 0 0 7 9 2 0 0 0 0 37 38 2 0 0 0 0 38 33 1 0 0 0 0 M END $$$$ -ISIS- 04110308462D 37 40 0 0 0 0 0 0 0 0999 V2000 0.3777 -3.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3766 -4.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0914 -4.5860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8078 -4.1727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 -3.3422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0896 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0833 -5.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6667 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4958 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5167 -2.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5125 -2.1000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8625 -1.5667 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3083 -1.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3042 -1.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0208 -2.2958 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 3.0958 -2.6833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0375 -1.5625 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 1.0333 -0.7375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0333 -2.3875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2125 -1.5583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0224 -2.2668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1995 -2.2678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1983 -0.8433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4292 -1.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4292 -3.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4357 -1.5479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.8382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4268 -0.1255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2490 -0.1213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6628 -0.8357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2537 -1.5455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2542 -3.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2529 -1.5798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6625 -2.2917 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.4875 -2.2917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0708 -1.7042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8958 -3.0042 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7 9 2 0 0 0 0 17 19 2 0 0 0 0 4 5 1 0 0 0 0 17 20 1 0 0 0 0 20 23 2 0 0 0 0 5 10 1 0 0 0 0 26 21 1 0 0 0 0 2 3 1 0 0 0 0 21 22 2 0 0 0 0 22 20 1 0 0 0 0 10 11 1 6 0 0 0 27 23 1 0 0 0 0 5 6 2 0 0 0 0 15 24 1 0 0 0 0 11 12 1 0 0 0 0 15 25 1 0 0 0 0 6 1 1 0 0 0 0 11 13 1 0 0 0 0 26 27 1 0 0 0 0 1 2 2 0 0 0 0 27 28 2 0 0 0 0 13 14 2 0 0 0 0 28 29 1 0 0 0 0 3 7 1 0 0 0 0 29 30 2 0 0 0 0 13 15 1 0 0 0 0 30 31 1 0 0 0 0 31 26 2 0 0 0 0 24 33 1 0 0 0 0 3 4 2 0 0 0 0 25 32 1 0 0 0 0 34 32 1 0 0 0 0 11 16 1 1 0 0 0 7 8 1 0 0 0 0 33 34 1 0 0 0 0 12 17 1 0 0 0 0 34 35 1 0 0 0 0 35 36 2 0 0 0 0 17 18 2 0 0 0 0 35 37 1 0 0 0 0 M END $$$$ -ISIS- 09220310532D 36 39 0 0 0 0 0 0 0 0999 V2000 -0.3890 -2.7708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3901 -3.5982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3247 -4.0110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0411 -3.5977 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0383 -2.7672 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3229 -2.3580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3166 -4.8333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9000 -5.4167 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2709 -5.4167 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7500 -2.3500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7458 -1.5250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.0958 -0.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5416 -1.3083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -2.1083 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2708 -0.9875 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 0.2666 -0.1625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2666 -1.8125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2541 -1.7208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5542 -0.9875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9648 -0.2707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7855 -1.7022 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9626 -1.6990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2024 -0.9854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7888 -0.2721 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1997 0.4406 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0240 0.4412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4357 -0.2768 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0224 -0.9866 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5333 -0.4792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9625 -1.3000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6750 -1.7125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6712 -2.5369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3829 -2.9493 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0974 -2.5384 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0957 -1.7109 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3835 -1.3022 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20 24 1 0 0 0 0 2 3 1 0 0 0 0 23 21 1 0 0 0 0 10 11 1 6 0 0 0 21 22 2 0 0 0 0 22 19 1 0 0 0 0 5 6 2 0 0 0 0 11 12 1 0 0 0 0 23 24 1 0 0 0 0 6 1 1 0 0 0 0 24 25 2 0 0 0 0 11 13 1 0 0 0 0 25 26 1 0 0 0 0 1 2 2 0 0 0 0 26 27 2 0 0 0 0 27 28 1 0 0 0 0 28 23 2 0 0 0 0 3 7 1 0 0 0 0 11 14 1 1 0 0 0 3 4 2 0 0 0 0 12 15 1 0 0 0 0 7 8 1 0 0 0 0 15 16 2 0 0 0 0 13 29 2 0 0 0 0 15 17 2 0 0 0 0 18 30 1 0 0 0 0 7 9 2 0 0 0 0 30 31 1 0 0 0 0 13 18 1 0 0 0 0 31 32 2 0 0 0 0 4 5 1 0 0 0 0 32 33 1 0 0 0 0 15 19 1 0 0 0 0 33 34 2 0 0 0 0 5 10 1 0 0 0 0 34 35 1 0 0 0 0 19 20 2 0 0 0 0 35 36 2 0 0 0 0 36 31 1 0 0 0 0 M END $$$$ -ISIS- 04110308472D 34 37 0 0 0 0 0 0 0 0999 V2000 0.3777 -3.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3766 -4.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0914 -4.5860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8078 -4.1727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 -3.3422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0896 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0833 -5.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6667 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4958 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5167 -2.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5125 -2.1000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8625 -1.5667 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3083 -1.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3042 -1.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0208 -2.2958 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 3.0958 -2.6833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0375 -1.5625 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 1.0333 -0.7375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0333 -2.3875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2125 -1.5583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0224 -2.2668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1995 -2.2678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1983 -0.8433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4292 -1.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4292 -3.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4357 -1.5479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.8382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4268 -0.1255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2490 -0.1213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6628 -0.8357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2537 -1.5455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2542 -3.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2529 -1.5798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6625 -2.2917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12 17 1 0 0 0 0 17 18 2 0 0 0 0 7 9 2 0 0 0 0 17 19 2 0 0 0 0 4 5 1 0 0 0 0 17 20 1 0 0 0 0 20 23 2 0 0 0 0 5 10 1 0 0 0 0 26 21 1 0 0 0 0 2 3 1 0 0 0 0 21 22 2 0 0 0 0 22 20 1 0 0 0 0 10 11 1 6 0 0 0 27 23 1 0 0 0 0 5 6 2 0 0 0 0 15 24 1 0 0 0 0 11 12 1 0 0 0 0 15 25 1 0 0 0 0 6 1 1 0 0 0 0 11 13 1 0 0 0 0 26 27 1 0 0 0 0 1 2 2 0 0 0 0 27 28 2 0 0 0 0 13 14 2 0 0 0 0 28 29 1 0 0 0 0 3 7 1 0 0 0 0 29 30 2 0 0 0 0 13 15 1 0 0 0 0 30 31 1 0 0 0 0 31 26 2 0 0 0 0 24 33 1 0 0 0 0 3 4 2 0 0 0 0 25 32 1 0 0 0 0 34 32 1 0 0 0 0 11 16 1 1 0 0 0 7 8 1 0 0 0 0 33 34 1 0 0 0 0 M END $$$$ -ISIS- 04110308482D 38 41 0 0 0 0 0 0 0 0999 V2000 0.3777 -3.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3766 -4.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0914 -4.5860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8078 -4.1727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 -3.3422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0896 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0833 -5.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6667 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4958 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5167 -2.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5125 -2.1000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8625 -1.5667 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3083 -1.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3042 -1.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0208 -2.2958 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 3.0958 -2.6833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0375 -1.5625 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 1.0333 -0.7375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0333 -2.3875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2125 -1.5583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0224 -2.2668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1995 -2.2678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1983 -0.8433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4292 -1.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4292 -3.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4357 -1.5479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.8382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4268 -0.1255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2490 -0.1213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6628 -0.8357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2537 -1.5455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2542 -3.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2529 -1.5798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6625 -2.2917 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 6.4875 -2.2917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0708 -1.7042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8958 -3.0042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7208 -3.0042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17 19 2 0 0 0 0 4 5 1 0 0 0 0 17 20 1 0 0 0 0 20 23 2 0 0 0 0 5 10 1 0 0 0 0 26 21 1 0 0 0 0 2 3 1 0 0 0 0 21 22 2 0 0 0 0 22 20 1 0 0 0 0 10 11 1 6 0 0 0 27 23 1 0 0 0 0 5 6 2 0 0 0 0 15 24 1 0 0 0 0 11 12 1 0 0 0 0 15 25 1 0 0 0 0 6 1 1 0 0 0 0 11 13 1 0 0 0 0 26 27 1 0 0 0 0 1 2 2 0 0 0 0 27 28 2 0 0 0 0 13 14 2 0 0 0 0 28 29 1 0 0 0 0 3 7 1 0 0 0 0 29 30 2 0 0 0 0 13 15 1 0 0 0 0 30 31 1 0 0 0 0 31 26 2 0 0 0 0 24 33 1 0 0 0 0 3 4 2 0 0 0 0 25 32 1 0 0 0 0 34 32 1 0 0 0 0 11 16 1 1 0 0 0 7 8 1 0 0 0 0 33 34 1 0 0 0 0 12 17 1 0 0 0 0 34 35 1 0 0 0 0 35 36 2 0 0 0 0 17 18 2 0 0 0 0 35 37 1 0 0 0 0 7 9 2 0 0 0 0 37 38 1 0 0 0 0 M END $$$$ -ISIS- 04110309432D 34 36 0 0 0 0 0 0 0 0999 V2000 0.2117 -1.5586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3777 -3.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3766 -4.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0914 -4.5860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8078 -4.1727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 -3.3422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0896 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0833 -5.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6667 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4958 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5167 -2.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5125 -2.1000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8625 -1.5667 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3083 -1.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3042 -1.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0958 -2.6833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0375 -1.5625 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 1.0333 -0.7375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0333 -2.3875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1042 -2.0958 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 4.5125 -1.3792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3375 -1.3792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5125 -2.8083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3375 -2.8083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7458 -2.0917 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.5708 -2.0917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1964 -0.8399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0214 -0.8357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4385 -1.5494 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0245 -2.2689 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2009 -2.2696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2083 -0.1208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2042 -2.9792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2667 -1.5417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8 9 1 0 0 0 0 17 18 2 0 0 0 0 17 19 2 0 0 0 0 8 10 2 0 0 0 0 14 20 1 0 0 0 0 5 6 1 0 0 0 0 20 21 1 0 0 0 0 6 11 1 0 0 0 0 21 22 1 0 0 0 0 22 25 1 0 0 0 0 3 4 1 0 0 0 0 20 23 1 0 0 0 0 11 12 1 6 0 0 0 23 24 1 0 0 0 0 6 7 2 0 0 0 0 24 25 1 0 0 0 0 12 13 1 0 0 0 0 25 26 1 0 0 0 0 17 1 1 0 0 0 0 7 2 1 0 0 0 0 1 27 2 0 0 0 0 12 14 1 0 0 0 0 27 28 1 0 0 0 0 2 3 2 0 0 0 0 28 29 2 0 0 0 0 14 15 2 0 0 0 0 29 30 1 0 0 0 0 4 8 1 0 0 0 0 30 31 2 0 0 0 0 31 1 1 0 0 0 0 12 16 1 1 0 0 0 27 32 1 0 0 0 0 4 5 2 0 0 0 0 31 33 1 0 0 0 0 13 17 1 0 0 0 0 29 34 1 0 0 0 0 M END $$$$ -ISIS- 04110308492D 34 37 0 0 0 0 0 0 0 0999 V2000 0.3777 -3.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3766 -4.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0914 -4.5860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8078 -4.1727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 -3.3422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0896 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0833 -5.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6667 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4958 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5167 -2.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5125 -2.1000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8625 -1.5667 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3083 -1.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3042 -1.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0208 -2.2958 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 3.0958 -2.6833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0375 -1.5625 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 1.0333 -0.7375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0333 -2.3875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2125 -1.5583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0224 -2.2668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1995 -2.2678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1983 -0.8433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4292 -1.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4292 -3.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4357 -1.5479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.8382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4268 -0.1255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2490 -0.1213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6628 -0.8357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2537 -1.5455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2542 -3.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2529 -1.5798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6625 -2.2917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12 17 1 0 0 0 0 17 18 2 0 0 0 0 7 9 2 0 0 0 0 17 19 2 0 0 0 0 4 5 1 0 0 0 0 17 20 1 0 0 0 0 20 23 2 0 0 0 0 5 10 1 0 0 0 0 26 21 1 0 0 0 0 2 3 1 0 0 0 0 21 22 2 0 0 0 0 22 20 1 0 0 0 0 10 11 1 6 0 0 0 27 23 1 0 0 0 0 5 6 2 0 0 0 0 15 24 1 0 0 0 0 11 12 1 0 0 0 0 15 25 1 0 0 0 0 6 1 1 0 0 0 0 11 13 1 0 0 0 0 26 27 1 0 0 0 0 1 2 2 0 0 0 0 27 28 2 0 0 0 0 13 14 2 0 0 0 0 28 29 1 0 0 0 0 3 7 1 0 0 0 0 29 30 2 0 0 0 0 13 15 1 0 0 0 0 30 31 1 0 0 0 0 31 26 2 0 0 0 0 24 33 1 0 0 0 0 3 4 2 0 0 0 0 25 32 1 0 0 0 0 34 32 1 0 0 0 0 11 16 1 1 0 0 0 7 8 1 0 0 0 0 33 34 1 0 0 0 0 M END $$$$ -ISIS- 04110309442D 40 42 0 0 0 0 0 0 0 0999 V2000 0.2117 -1.5586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3777 -3.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3766 -4.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0914 -4.5860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8078 -4.1727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 -3.3422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0896 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0833 -5.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6667 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4958 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5167 -2.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5125 -2.1000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8625 -1.5667 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3083 -1.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3042 -1.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0958 -2.6833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0375 -1.5625 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 1.0333 -0.7375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0333 -2.3875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1042 -2.0958 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 4.5125 -1.3792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3375 -1.3792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5125 -2.8083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3375 -2.8083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7458 -2.0917 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.5708 -2.0917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1964 -0.8399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0214 -0.8357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4385 -1.5494 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0245 -2.2689 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2009 -2.2696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2667 -1.5417 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.6833 -0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6833 -2.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2042 -0.0125 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5083 0.4042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7917 0.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2083 -3.0917 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0083 -3.3042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0042 -3.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5 6 1 0 0 0 0 20 21 1 0 0 0 0 6 11 1 0 0 0 0 21 22 1 0 0 0 0 22 25 1 0 0 0 0 3 4 1 0 0 0 0 20 23 1 0 0 0 0 11 12 1 6 0 0 0 23 24 1 0 0 0 0 6 7 2 0 0 0 0 24 25 1 0 0 0 0 12 13 1 0 0 0 0 25 26 1 0 0 0 0 17 1 1 0 0 0 0 7 2 1 0 0 0 0 1 27 2 0 0 0 0 12 14 1 0 0 0 0 27 28 1 0 0 0 0 2 3 2 0 0 0 0 28 29 2 0 0 0 0 14 15 2 0 0 0 0 29 30 1 0 0 0 0 4 8 1 0 0 0 0 30 31 2 0 0 0 0 31 1 1 0 0 0 0 12 16 1 1 0 0 0 29 32 1 0 0 0 0 4 5 2 0 0 0 0 32 33 1 0 0 0 0 13 17 1 0 0 0 0 32 34 1 0 0 0 0 8 9 1 0 0 0 0 27 35 1 0 0 0 0 17 18 2 0 0 0 0 35 36 1 0 0 0 0 35 37 1 0 0 0 0 17 19 2 0 0 0 0 31 38 1 0 0 0 0 8 10 2 0 0 0 0 38 39 1 0 0 0 0 14 20 1 0 0 0 0 38 40 1 0 0 0 0 M END $$$$ -ISIS- 04110309442D 36 38 0 0 0 0 0 0 0 0999 V2000 0.2117 -1.5586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3777 -3.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3766 -4.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0914 -4.5860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8078 -4.1727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 -3.3422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0896 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0833 -5.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6667 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4958 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5167 -2.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5125 -2.1000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8625 -1.5667 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3083 -1.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3042 -1.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0958 -2.6833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0375 -1.5625 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 1.0333 -0.7375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0333 -2.3875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1042 -2.0958 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 4.5125 -1.3792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3375 -1.3792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5125 -2.8083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3375 -2.8083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7458 -2.0917 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.5708 -2.0917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1964 -0.8399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0214 -0.8357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4385 -1.5494 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0245 -2.2689 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2009 -2.2696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2083 -0.1208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2042 -2.9792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6125 -2.8500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2667 -1.5417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0917 -1.5417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17 19 2 0 0 0 0 8 10 2 0 0 0 0 14 20 1 0 0 0 0 5 6 1 0 0 0 0 20 21 1 0 0 0 0 6 11 1 0 0 0 0 21 22 1 0 0 0 0 22 25 1 0 0 0 0 3 4 1 0 0 0 0 20 23 1 0 0 0 0 11 12 1 6 0 0 0 23 24 1 0 0 0 0 6 7 2 0 0 0 0 24 25 1 0 0 0 0 12 13 1 0 0 0 0 25 26 1 0 0 0 0 17 1 1 0 0 0 0 7 2 1 0 0 0 0 1 27 2 0 0 0 0 12 14 1 0 0 0 0 27 28 1 0 0 0 0 2 3 2 0 0 0 0 28 29 2 0 0 0 0 14 15 2 0 0 0 0 29 30 1 0 0 0 0 4 8 1 0 0 0 0 30 31 2 0 0 0 0 31 1 1 0 0 0 0 12 16 1 1 0 0 0 27 32 1 0 0 0 0 4 5 2 0 0 0 0 31 33 1 0 0 0 0 13 17 1 0 0 0 0 30 34 1 0 0 0 0 8 9 1 0 0 0 0 29 35 1 0 0 0 0 17 18 2 0 0 0 0 35 36 1 0 0 0 0 M END $$$$ -ISIS- 04110308502D 39 42 0 0 0 0 0 0 0 0999 V2000 0.3777 -3.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3766 -4.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0914 -4.5860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8078 -4.1727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 -3.3422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0896 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0833 -5.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6667 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4958 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5167 -2.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5125 -2.1000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8625 -1.5667 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3083 -1.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3042 -1.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0208 -2.2958 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 3.0958 -2.6833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0375 -1.5625 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 1.0333 -0.7375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0333 -2.3875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2125 -1.5583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0224 -2.2668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1995 -2.2678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1983 -0.8433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4292 -1.5792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.4292 -3.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4357 -1.5479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.8382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4268 -0.1255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2490 -0.1213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6628 -0.8357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2537 -1.5455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2542 -3.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2529 -1.5798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6625 -2.2917 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.6250 -0.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3375 -0.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8417 -0.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0042 0.5875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4875 -2.2917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4 5 1 0 0 0 0 17 20 1 0 0 0 0 20 23 2 0 0 0 0 5 10 1 0 0 0 0 26 21 1 0 0 0 0 2 3 1 0 0 0 0 21 22 2 0 0 0 0 22 20 1 0 0 0 0 10 11 1 6 0 0 0 27 23 1 0 0 0 0 5 6 2 0 0 0 0 15 24 1 0 0 0 0 11 12 1 0 0 0 0 15 25 1 0 0 0 0 6 1 1 0 0 0 0 11 13 1 0 0 0 0 26 27 1 0 0 0 0 1 2 2 0 0 0 0 27 28 2 0 0 0 0 13 14 2 0 0 0 0 28 29 1 0 0 0 0 3 7 1 0 0 0 0 29 30 2 0 0 0 0 13 15 1 0 0 0 0 30 31 1 0 0 0 0 31 26 2 0 0 0 0 24 33 1 0 0 0 0 3 4 2 0 0 0 0 25 32 1 0 0 0 0 34 32 1 0 0 0 0 11 16 1 1 0 0 0 7 8 1 0 0 0 0 33 34 1 0 0 0 0 12 17 1 0 0 0 0 24 35 1 1 0 0 0 35 36 2 0 0 0 0 17 18 2 0 0 0 0 35 37 1 0 0 0 0 7 9 2 0 0 0 0 37 38 1 0 0 0 0 17 19 2 0 0 0 0 34 39 1 6 0 0 0 M END $$$$ -ISIS- 04110309172D 32 34 0 0 0 0 0 0 0 0999 V2000 0.3777 -3.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3766 -4.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0914 -4.5860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8078 -4.1727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 -3.3422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0896 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0833 -5.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6667 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4958 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5167 -2.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5125 -2.1000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8625 -1.5667 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3083 -1.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3042 -1.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0958 -2.6833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0375 -1.5625 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 1.0333 -0.7375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0333 -2.3875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0208 -2.2958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2125 -1.5625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1981 -0.8457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0188 -2.2772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1959 -2.2740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4357 -1.5604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0221 -0.8471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.1344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2573 -0.1338 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6690 -0.8518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2557 -1.5616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6042 -2.8792 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.4292 -2.8792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6000 -3.7042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12 16 1 0 0 0 0 7 8 1 0 0 0 0 16 17 2 0 0 0 0 16 18 2 0 0 0 0 7 9 2 0 0 0 0 13 19 1 0 0 0 0 4 5 1 0 0 0 0 16 20 1 0 0 0 0 5 10 1 0 0 0 0 20 21 2 0 0 0 0 21 25 1 0 0 0 0 2 3 1 0 0 0 0 24 22 1 0 0 0 0 10 11 1 6 0 0 0 22 23 2 0 0 0 0 23 20 1 0 0 0 0 5 6 2 0 0 0 0 11 12 1 0 0 0 0 24 25 1 0 0 0 0 6 1 1 0 0 0 0 25 26 2 0 0 0 0 11 13 1 0 0 0 0 26 27 1 0 0 0 0 1 2 2 0 0 0 0 27 28 2 0 0 0 0 13 14 2 0 0 0 0 28 29 1 0 0 0 0 29 24 2 0 0 0 0 3 7 1 0 0 0 0 19 30 1 0 0 0 0 11 15 1 1 0 0 0 30 31 1 0 0 0 0 3 4 2 0 0 0 0 30 32 1 0 0 0 0 M END $$$$ -ISIS- 04110309192D 41 45 0 0 0 0 0 0 0 0999 V2000 0.3777 -3.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3766 -4.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0914 -4.5860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8078 -4.1727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 -3.3422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0896 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0833 -5.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6667 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4958 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5167 -2.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5125 -2.1000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8625 -1.5667 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3083 -1.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3042 -1.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0958 -2.6833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0375 -1.5625 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 1.0333 -0.7375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0333 -2.3875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0208 -2.2958 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 0.2125 -1.5625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1981 -0.8457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0188 -2.2772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1959 -2.2740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4357 -1.5604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0221 -0.8471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.1344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2573 -0.1338 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6690 -0.8518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2557 -1.5616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4292 -1.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4292 -3.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2542 -3.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2529 -1.5798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6625 -2.2917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4819 -2.2919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8926 -1.5810 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4780 -0.8685 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6600 -0.8718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2125 -3.8042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4125 -4.0167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7958 -4.3875 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 5 10 1 0 0 0 0 20 21 2 0 0 0 0 21 25 1 0 0 0 0 2 3 1 0 0 0 0 24 22 1 0 0 0 0 10 11 1 6 0 0 0 22 23 2 0 0 0 0 23 20 1 0 0 0 0 5 6 2 0 0 0 0 11 12 1 0 0 0 0 24 25 1 0 0 0 0 6 1 1 0 0 0 0 25 26 2 0 0 0 0 11 13 1 0 0 0 0 26 27 1 0 0 0 0 1 2 2 0 0 0 0 27 28 2 0 0 0 0 13 14 2 0 0 0 0 28 29 1 0 0 0 0 29 24 2 0 0 0 0 3 7 1 0 0 0 0 19 30 1 0 0 0 0 11 15 1 1 0 0 0 19 31 1 0 0 0 0 30 33 1 0 0 0 0 34 32 1 0 0 0 0 3 4 2 0 0 0 0 31 32 2 0 0 0 0 12 16 1 0 0 0 0 7 8 1 0 0 0 0 33 34 2 0 0 0 0 16 17 2 0 0 0 0 34 35 1 0 0 0 0 35 36 2 0 0 0 0 16 18 2 0 0 0 0 36 37 1 0 0 0 0 7 9 2 0 0 0 0 37 38 2 0 0 0 0 38 33 1 0 0 0 0 13 19 1 0 0 0 0 31 39 1 0 0 0 0 4 5 1 0 0 0 0 39 40 2 0 0 0 0 16 20 1 0 0 0 0 39 41 1 0 0 0 0 M CHG 1 41 -1 M END $$$$ -ISIS- 04110309192D 38 42 0 0 0 0 0 0 0 0999 V2000 0.3777 -3.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3766 -4.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0914 -4.5860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8078 -4.1727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 -3.3422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0896 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0833 -5.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6667 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4958 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5167 -2.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5125 -2.1000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8625 -1.5667 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3083 -1.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3042 -1.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0958 -2.6833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0375 -1.5625 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 1.0333 -0.7375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0333 -2.3875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0208 -2.2958 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 0.2125 -1.5625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1981 -0.8457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0188 -2.2772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1959 -2.2740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4357 -1.5604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0221 -0.8471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.1344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2573 -0.1338 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6690 -0.8518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2557 -1.5616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4292 -3.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6625 -2.2917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2458 -3.0042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4291 -1.5806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2542 -1.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6636 -0.8651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2492 -0.1520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4211 -0.1574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0153 -0.8720 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13 19 1 0 0 0 0 4 5 1 0 0 0 0 16 20 1 0 0 0 0 5 10 1 0 0 0 0 20 21 2 0 0 0 0 21 25 1 0 0 0 0 2 3 1 0 0 0 0 24 22 1 0 0 0 0 10 11 1 6 0 0 0 22 23 2 0 0 0 0 23 20 1 0 0 0 0 5 6 2 0 0 0 0 11 12 1 0 0 0 0 24 25 1 0 0 0 0 6 1 1 0 0 0 0 25 26 2 0 0 0 0 11 13 1 0 0 0 0 26 27 1 0 0 0 0 1 2 2 0 0 0 0 27 28 2 0 0 0 0 13 14 2 0 0 0 0 28 29 1 0 0 0 0 29 24 2 0 0 0 0 19 33 1 0 0 0 0 3 7 1 0 0 0 0 19 30 1 0 0 0 0 11 15 1 1 0 0 0 34 31 1 0 0 0 0 3 4 2 0 0 0 0 31 32 1 0 0 0 0 30 32 1 0 0 0 0 12 16 1 0 0 0 0 7 8 1 0 0 0 0 33 34 2 0 0 0 0 16 17 2 0 0 0 0 34 35 1 0 0 0 0 35 36 2 0 0 0 0 16 18 2 0 0 0 0 36 37 1 0 0 0 0 7 9 2 0 0 0 0 37 38 2 0 0 0 0 38 33 1 0 0 0 0 M END $$$$ -ISIS- 04110309202D 33 35 0 0 0 0 0 0 0 0999 V2000 0.3777 -3.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3766 -4.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0914 -4.5860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8078 -4.1727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 -3.3422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0896 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0833 -5.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6667 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4958 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5167 -2.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5125 -2.1000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8625 -1.5667 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3083 -1.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3042 -1.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0958 -2.6833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0375 -1.5625 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 1.0333 -0.7375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0333 -2.3875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0208 -2.2958 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2125 -1.5625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1981 -0.8457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0188 -2.2772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1959 -2.2740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4357 -1.5604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0221 -0.8471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.1344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2573 -0.1338 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6690 -0.8518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2557 -1.5616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7333 -1.8792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4458 -2.2917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1583 -1.8750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8708 -2.2875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7 8 1 0 0 0 0 16 17 2 0 0 0 0 16 18 2 0 0 0 0 7 9 2 0 0 0 0 13 19 1 0 0 0 0 4 5 1 0 0 0 0 16 20 1 0 0 0 0 5 10 1 0 0 0 0 20 21 2 0 0 0 0 21 25 1 0 0 0 0 2 3 1 0 0 0 0 24 22 1 0 0 0 0 10 11 1 6 0 0 0 22 23 2 0 0 0 0 23 20 1 0 0 0 0 5 6 2 0 0 0 0 11 12 1 0 0 0 0 24 25 1 0 0 0 0 6 1 1 0 0 0 0 25 26 2 0 0 0 0 11 13 1 0 0 0 0 26 27 1 0 0 0 0 1 2 2 0 0 0 0 27 28 2 0 0 0 0 13 14 2 0 0 0 0 28 29 1 0 0 0 0 29 24 2 0 0 0 0 3 7 1 0 0 0 0 19 30 1 0 0 0 0 11 15 1 1 0 0 0 30 31 1 0 0 0 0 3 4 2 0 0 0 0 31 32 1 0 0 0 0 12 16 1 0 0 0 0 32 33 1 0 0 0 0 M END $$$$ -ISIS- 04110308522D 38 41 0 0 0 0 0 0 0 0999 V2000 0.3777 -3.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3766 -4.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0914 -4.5860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8078 -4.1727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 -3.3422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0896 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0833 -5.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6667 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4958 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5167 -2.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5125 -2.1000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8625 -1.5667 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3083 -1.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3042 -1.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0958 -2.6833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0375 -1.5625 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 1.0333 -0.7375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0333 -2.3875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2125 -1.5583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0224 -2.2668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1995 -2.2678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1983 -0.8433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4357 -1.5479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.8382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4268 -0.1255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2490 -0.1213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6628 -0.8357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2537 -1.5455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0208 -2.2958 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 4.4292 -1.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4292 -3.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2542 -1.5792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.2542 -3.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6625 -2.2917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5875 -0.8167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8708 -0.4042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3833 -0.6000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7917 0.1167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16 19 1 0 0 0 0 19 22 2 0 0 0 0 4 5 1 0 0 0 0 23 20 1 0 0 0 0 5 10 1 0 0 0 0 20 21 2 0 0 0 0 21 19 1 0 0 0 0 2 3 1 0 0 0 0 24 22 1 0 0 0 0 10 11 1 6 0 0 0 5 6 2 0 0 0 0 23 24 1 0 0 0 0 11 12 1 0 0 0 0 24 25 2 0 0 0 0 6 1 1 0 0 0 0 25 26 1 0 0 0 0 11 13 1 0 0 0 0 26 27 2 0 0 0 0 1 2 2 0 0 0 0 27 28 1 0 0 0 0 28 23 2 0 0 0 0 13 14 2 0 0 0 0 13 29 1 0 0 0 0 3 7 1 0 0 0 0 29 30 1 0 0 0 0 11 15 1 1 0 0 0 29 31 1 0 0 0 0 3 4 2 0 0 0 0 30 32 1 0 0 0 0 12 16 1 0 0 0 0 31 33 1 0 0 0 0 7 8 1 0 0 0 0 32 34 1 0 0 0 0 33 34 1 0 0 0 0 16 17 2 0 0 0 0 32 35 1 1 0 0 0 35 36 2 0 0 0 0 16 18 2 0 0 0 0 35 37 1 0 0 0 0 7 9 2 0 0 0 0 37 38 1 0 0 0 0 M END $$$$ -ISIS- 04110309452D 43 45 0 0 0 0 0 0 0 0999 V2000 0.2117 -1.5586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3777 -3.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3766 -4.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0914 -4.5860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8078 -4.1727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 -3.3422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0896 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0833 -5.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6667 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4958 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5167 -2.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5125 -2.1000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8625 -1.5667 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3083 -1.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3042 -1.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0958 -2.6833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0375 -1.5625 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 1.0333 -0.7375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0333 -2.3875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1042 -2.0958 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 4.5125 -1.3792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3375 -1.3792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5125 -2.8083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3375 -2.8083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7458 -2.0917 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.5708 -2.0917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1964 -0.8399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0214 -0.8357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4385 -1.5494 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0245 -2.2689 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2009 -2.2696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5667 -2.9167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1542 -1.5042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9792 -1.5042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2042 -0.0125 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3792 0.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7917 0.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2083 -3.0917 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9250 -3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0042 -3.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2667 -1.5417 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.8542 -0.9542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8542 -2.1250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21 22 1 0 0 0 0 22 25 1 0 0 0 0 3 4 1 0 0 0 0 20 23 1 0 0 0 0 11 12 1 6 0 0 0 23 24 1 0 0 0 0 6 7 2 0 0 0 0 24 25 1 0 0 0 0 12 13 1 0 0 0 0 25 26 1 0 0 0 0 17 1 1 0 0 0 0 7 2 1 0 0 0 0 1 27 2 0 0 0 0 12 14 1 0 0 0 0 27 28 1 0 0 0 0 2 3 2 0 0 0 0 28 29 2 0 0 0 0 14 15 2 0 0 0 0 29 30 1 0 0 0 0 4 8 1 0 0 0 0 30 31 2 0 0 0 0 31 1 1 0 0 0 0 12 16 1 1 0 0 0 26 32 2 0 0 0 0 4 5 2 0 0 0 0 26 33 1 0 0 0 0 13 17 1 0 0 0 0 33 34 1 0 0 0 0 8 9 1 0 0 0 0 27 35 1 0 0 0 0 17 18 2 0 0 0 0 35 36 1 0 0 0 0 35 37 1 0 0 0 0 17 19 2 0 0 0 0 31 38 1 0 0 0 0 8 10 2 0 0 0 0 38 39 1 0 0 0 0 14 20 1 0 0 0 0 38 40 1 0 0 0 0 5 6 1 0 0 0 0 29 41 1 0 0 0 0 20 21 1 0 0 0 0 41 42 1 0 0 0 0 6 11 1 0 0 0 0 41 43 1 0 0 0 0 M END $$$$ -ISIS- 04110308542D 38 41 0 0 0 0 0 0 0 0999 V2000 0.3777 -3.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3766 -4.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0914 -4.5860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8078 -4.1727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 -3.3422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0896 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0833 -5.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6667 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4958 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5167 -2.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5125 -2.1000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8625 -1.5667 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3083 -1.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3042 -1.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0958 -2.6833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0375 -1.5625 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 1.0333 -0.7375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0333 -2.3875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2125 -1.5583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0224 -2.2668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1995 -2.2678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1983 -0.8433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4357 -1.5479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.8382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4268 -0.1255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2490 -0.1213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6628 -0.8357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2537 -1.5455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0208 -2.2958 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 4.4292 -1.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4292 -3.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2542 -1.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2542 -3.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6625 -2.2917 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.4875 -2.2917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8958 -1.5750 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0708 -2.8750 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7833 -2.4583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16 19 1 0 0 0 0 19 22 2 0 0 0 0 4 5 1 0 0 0 0 23 20 1 0 0 0 0 5 10 1 0 0 0 0 20 21 2 0 0 0 0 21 19 1 0 0 0 0 2 3 1 0 0 0 0 24 22 1 0 0 0 0 10 11 1 6 0 0 0 5 6 2 0 0 0 0 23 24 1 0 0 0 0 11 12 1 0 0 0 0 24 25 2 0 0 0 0 6 1 1 0 0 0 0 25 26 1 0 0 0 0 11 13 1 0 0 0 0 26 27 2 0 0 0 0 1 2 2 0 0 0 0 27 28 1 0 0 0 0 28 23 2 0 0 0 0 13 14 2 0 0 0 0 13 29 1 0 0 0 0 3 7 1 0 0 0 0 29 30 1 0 0 0 0 11 15 1 1 0 0 0 29 31 1 0 0 0 0 3 4 2 0 0 0 0 30 32 1 0 0 0 0 12 16 1 0 0 0 0 31 33 1 0 0 0 0 7 8 1 0 0 0 0 32 34 1 0 0 0 0 33 34 1 0 0 0 0 16 17 2 0 0 0 0 34 35 1 0 0 0 0 35 36 2 0 0 0 0 16 18 2 0 0 0 0 35 37 1 0 0 0 0 7 9 2 0 0 0 0 37 38 1 0 0 0 0 M END $$$$ -ISIS- 04110309462D 37 39 0 0 0 0 0 0 0 0999 V2000 0.2117 -1.5586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3777 -3.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3766 -4.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0914 -4.5860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8078 -4.1727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 -3.3422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0896 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0833 -5.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6667 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4958 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5167 -2.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5125 -2.1000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8625 -1.5667 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3083 -1.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3042 -1.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0958 -2.6833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0375 -1.5625 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 1.0333 -0.7375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0333 -2.3875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1042 -2.0958 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 4.5125 -1.3792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3375 -1.3792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5125 -2.8083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3375 -2.8083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7458 -2.0917 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.5708 -2.0917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1964 -0.8399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0214 -0.8357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4385 -1.5494 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0245 -2.2689 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2009 -2.2696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5667 -2.9167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1542 -1.5042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9792 -1.5042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3833 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2042 -2.9792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2667 -1.5417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17 19 2 0 0 0 0 8 10 2 0 0 0 0 14 20 1 0 0 0 0 5 6 1 0 0 0 0 20 21 1 0 0 0 0 6 11 1 0 0 0 0 21 22 1 0 0 0 0 22 25 1 0 0 0 0 3 4 1 0 0 0 0 20 23 1 0 0 0 0 11 12 1 6 0 0 0 23 24 1 0 0 0 0 6 7 2 0 0 0 0 24 25 1 0 0 0 0 12 13 1 0 0 0 0 25 26 1 0 0 0 0 17 1 1 0 0 0 0 7 2 1 0 0 0 0 1 27 2 0 0 0 0 12 14 1 0 0 0 0 27 28 1 0 0 0 0 2 3 2 0 0 0 0 28 29 2 0 0 0 0 14 15 2 0 0 0 0 29 30 1 0 0 0 0 4 8 1 0 0 0 0 30 31 2 0 0 0 0 31 1 1 0 0 0 0 12 16 1 1 0 0 0 26 32 2 0 0 0 0 4 5 2 0 0 0 0 26 33 1 0 0 0 0 13 17 1 0 0 0 0 33 34 1 0 0 0 0 8 9 1 0 0 0 0 27 35 1 0 0 0 0 17 18 2 0 0 0 0 31 36 1 0 0 0 0 29 37 1 0 0 0 0 M END $$$$ -ISIS- 04110309272D 42 46 0 0 0 0 0 0 0 0999 V2000 4.0220 -2.2961 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 0.3777 -3.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3766 -4.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0914 -4.5860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8078 -4.1727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 -3.3422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0896 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0833 -5.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6667 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4958 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5167 -2.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5125 -2.1000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8625 -1.5667 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3083 -1.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3042 -1.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0958 -2.6833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0375 -1.5625 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 1.0333 -0.7375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0333 -2.3875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2125 -1.5625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1981 -0.8457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0188 -2.2772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1959 -2.2740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4357 -1.5604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0221 -0.8471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.1344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2573 -0.1338 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6690 -0.8518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2557 -1.5616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0167 -3.1208 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7333 -1.8792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7250 -3.5250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4444 -2.2916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4417 -3.1167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1537 -3.5298 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8689 -3.1189 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8676 -2.2907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1550 -1.8814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6000 -3.8333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7750 -3.8333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0083 -4.5458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5917 -5.2583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21 25 1 0 0 0 0 6 11 1 0 0 0 0 24 22 1 0 0 0 0 3 4 1 0 0 0 0 22 23 2 0 0 0 0 23 20 1 0 0 0 0 11 12 1 6 0 0 0 6 7 2 0 0 0 0 24 25 1 0 0 0 0 12 13 1 0 0 0 0 25 26 2 0 0 0 0 7 2 1 0 0 0 0 26 27 1 0 0 0 0 12 14 1 0 0 0 0 27 28 2 0 0 0 0 2 3 2 0 0 0 0 28 29 1 0 0 0 0 29 24 2 0 0 0 0 14 1 1 0 0 0 0 14 15 2 0 0 0 0 1 30 1 0 0 0 0 30 32 1 0 0 0 0 4 8 1 0 0 0 0 1 31 1 0 0 0 0 31 33 1 0 0 0 0 12 16 1 1 0 0 0 34 32 1 0 0 0 0 4 5 2 0 0 0 0 13 17 1 0 0 0 0 33 34 2 0 0 0 0 8 9 1 0 0 0 0 34 35 1 0 0 0 0 17 18 2 0 0 0 0 35 36 2 0 0 0 0 36 37 1 0 0 0 0 17 19 2 0 0 0 0 37 38 2 0 0 0 0 38 33 1 0 0 0 0 8 10 2 0 0 0 0 30 39 1 6 0 0 0 17 20 1 0 0 0 0 39 40 2 0 0 0 0 5 6 1 0 0 0 0 39 41 1 0 0 0 0 20 21 2 0 0 0 0 41 42 1 0 0 0 0 M END $$$$ -ISIS- 04110309212D 43 47 0 0 0 0 0 0 0 0999 V2000 0.3777 -3.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3766 -4.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0914 -4.5860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8078 -4.1727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 -3.3422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0896 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0833 -5.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6667 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4958 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5167 -2.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5125 -2.1000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8625 -1.5667 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3083 -1.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3042 -1.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0958 -2.6833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0375 -1.5625 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 1.0333 -0.7375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0333 -2.3875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2125 -1.5625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1981 -0.8457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0188 -2.2772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1959 -2.2740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4357 -1.5604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0221 -0.8471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.1344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2573 -0.1338 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6690 -0.8518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2557 -1.5616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0208 -2.2958 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 4.4292 -1.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2542 -1.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6625 -2.2917 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.2458 -3.0042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4208 -3.0042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4875 -2.2917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0708 -1.7042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8958 -3.0042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6917 -3.2167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9032 -4.0139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6982 -4.2265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2810 -3.6433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0635 -2.8444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2689 -2.6355 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23 21 1 0 0 0 0 2 3 1 0 0 0 0 21 22 2 0 0 0 0 22 19 1 0 0 0 0 10 11 1 6 0 0 0 5 6 2 0 0 0 0 23 24 1 0 0 0 0 11 12 1 0 0 0 0 24 25 2 0 0 0 0 6 1 1 0 0 0 0 25 26 1 0 0 0 0 11 13 1 0 0 0 0 26 27 2 0 0 0 0 1 2 2 0 0 0 0 27 28 1 0 0 0 0 28 23 2 0 0 0 0 13 14 2 0 0 0 0 13 29 1 0 0 0 0 3 7 1 0 0 0 0 29 30 1 0 0 0 0 11 15 1 1 0 0 0 30 31 1 0 0 0 0 3 4 2 0 0 0 0 31 32 1 0 0 0 0 12 16 1 0 0 0 0 32 33 1 0 0 0 0 7 8 1 0 0 0 0 33 34 1 0 0 0 0 34 29 1 0 0 0 0 16 17 2 0 0 0 0 32 35 1 0 0 0 0 35 36 2 0 0 0 0 16 18 2 0 0 0 0 35 37 1 0 0 0 0 7 9 2 0 0 0 0 37 38 1 0 0 0 0 16 19 1 0 0 0 0 38 39 2 0 0 0 0 4 5 1 0 0 0 0 39 40 1 0 0 0 0 19 20 2 0 0 0 0 40 41 2 0 0 0 0 20 24 1 0 0 0 0 41 42 1 0 0 0 0 5 10 1 0 0 0 0 42 43 2 0 0 0 0 43 38 1 0 0 0 0 M END $$$$ -ISIS- 04110308342D 34 37 0 0 0 0 0 0 0 0999 V2000 0.3777 -3.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3766 -4.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0914 -4.5860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8078 -4.1727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 -3.3422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0896 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0833 -5.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6667 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4958 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5167 -2.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5125 -2.1000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8625 -1.5667 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3083 -1.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3042 -1.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0208 -2.2958 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 3.0958 -2.6833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0375 -1.5625 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 1.0333 -0.7375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0333 -2.3875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2125 -1.5583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4357 -1.5479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0224 -2.2668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 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0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 1.0333 -0.7375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0333 -2.3875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1042 -2.0958 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 4.5125 -1.3792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3375 -1.3792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5125 -2.8083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3375 -2.8083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7458 -2.0917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1964 -0.8399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0214 -0.8357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4385 -1.5494 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0245 -2.2689 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2009 -2.2696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2667 -1.5417 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.8542 -0.9542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8542 -2.1250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2042 -0.0125 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3792 0.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7917 0.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2083 -3.0917 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0042 -3.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9250 -3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7458 -0.6625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5292 0.1375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5708 -0.6625 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1542 -0.0750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21 22 1 0 0 0 0 22 25 1 0 0 0 0 3 4 1 0 0 0 0 20 23 1 0 0 0 0 11 12 1 6 0 0 0 23 24 1 0 0 0 0 6 7 2 0 0 0 0 24 25 1 0 0 0 0 17 1 1 0 0 0 0 12 13 1 0 0 0 0 1 26 2 0 0 0 0 7 2 1 0 0 0 0 26 27 1 0 0 0 0 12 14 1 0 0 0 0 27 28 2 0 0 0 0 2 3 2 0 0 0 0 28 29 1 0 0 0 0 14 15 2 0 0 0 0 29 30 2 0 0 0 0 30 1 1 0 0 0 0 4 8 1 0 0 0 0 28 31 1 0 0 0 0 12 16 1 1 0 0 0 31 32 1 0 0 0 0 4 5 2 0 0 0 0 31 33 1 0 0 0 0 13 17 1 0 0 0 0 26 34 1 0 0 0 0 8 9 1 0 0 0 0 34 35 1 0 0 0 0 17 18 2 0 0 0 0 34 36 1 0 0 0 0 30 37 1 0 0 0 0 17 19 2 0 0 0 0 37 38 1 0 0 0 0 8 10 2 0 0 0 0 37 39 1 0 0 0 0 14 20 1 0 0 0 0 22 40 1 1 0 0 0 5 6 1 0 0 0 0 40 41 2 0 0 0 0 20 21 1 0 0 0 0 40 42 1 0 0 0 0 6 11 1 0 0 0 0 42 43 1 0 0 0 0 M END $$$$ -ISIS- 04110308552D 37 40 0 0 0 0 0 0 0 0999 V2000 0.3777 -3.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3766 -4.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0914 -4.5860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8078 -4.1727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 -3.3422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0896 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0833 -5.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6667 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4958 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5167 -2.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5125 -2.1000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8625 -1.5667 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3083 -1.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3042 -1.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0958 -2.6833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0375 -1.5625 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 1.0333 -0.7375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0333 -2.3875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2125 -1.5583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0224 -2.2668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1995 -2.2678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1983 -0.8433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4357 -1.5479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.8382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4268 -0.1255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2490 -0.1213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6628 -0.8357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2537 -1.5455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0208 -2.2958 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 4.4292 -1.5792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.4292 -3.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2542 -1.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2542 -3.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6625 -2.2917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4250 -0.7542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8375 -0.1667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1375 -0.3375 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 7 9 2 0 0 0 0 16 19 1 0 0 0 0 19 22 2 0 0 0 0 4 5 1 0 0 0 0 23 20 1 0 0 0 0 5 10 1 0 0 0 0 20 21 2 0 0 0 0 21 19 1 0 0 0 0 2 3 1 0 0 0 0 24 22 1 0 0 0 0 10 11 1 6 0 0 0 5 6 2 0 0 0 0 23 24 1 0 0 0 0 11 12 1 0 0 0 0 24 25 2 0 0 0 0 6 1 1 0 0 0 0 25 26 1 0 0 0 0 11 13 1 0 0 0 0 26 27 2 0 0 0 0 1 2 2 0 0 0 0 27 28 1 0 0 0 0 28 23 2 0 0 0 0 13 14 2 0 0 0 0 13 29 1 0 0 0 0 3 7 1 0 0 0 0 29 30 1 0 0 0 0 11 15 1 1 0 0 0 29 31 1 0 0 0 0 3 4 2 0 0 0 0 30 32 1 0 0 0 0 12 16 1 0 0 0 0 31 33 1 0 0 0 0 7 8 1 0 0 0 0 32 34 1 0 0 0 0 33 34 1 0 0 0 0 16 17 2 0 0 0 0 30 35 1 1 0 0 0 35 36 2 0 0 0 0 16 18 2 0 0 0 0 35 37 1 0 0 0 0 M CHG 1 37 -1 M END $$$$ -ISIS- 04110309222D 30 32 0 0 0 0 0 0 0 0999 V2000 0.3777 -3.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3766 -4.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0914 -4.5860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8078 -4.1727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 -3.3422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0896 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0833 -5.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6667 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4958 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5167 -2.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5125 -2.1000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8625 -1.5667 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3083 -1.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3042 -1.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0958 -2.6833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0375 -1.5625 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 1.0333 -0.7375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0333 -2.3875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2125 -1.5625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1981 -0.8457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0188 -2.2772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1959 -2.2740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4357 -1.5604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0221 -0.8471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.1344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2573 -0.1338 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6690 -0.8518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2557 -1.5616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0208 -2.2958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7333 -1.8792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11 15 1 1 0 0 0 3 4 2 0 0 0 0 12 16 1 0 0 0 0 7 8 1 0 0 0 0 16 17 2 0 0 0 0 16 18 2 0 0 0 0 7 9 2 0 0 0 0 16 19 1 0 0 0 0 4 5 1 0 0 0 0 19 20 2 0 0 0 0 20 24 1 0 0 0 0 5 10 1 0 0 0 0 23 21 1 0 0 0 0 2 3 1 0 0 0 0 21 22 2 0 0 0 0 22 19 1 0 0 0 0 10 11 1 6 0 0 0 5 6 2 0 0 0 0 23 24 1 0 0 0 0 11 12 1 0 0 0 0 24 25 2 0 0 0 0 6 1 1 0 0 0 0 25 26 1 0 0 0 0 11 13 1 0 0 0 0 26 27 2 0 0 0 0 1 2 2 0 0 0 0 27 28 1 0 0 0 0 28 23 2 0 0 0 0 13 14 2 0 0 0 0 13 29 1 0 0 0 0 3 7 1 0 0 0 0 29 30 1 0 0 0 0 M END $$$$ -ISIS- 04110308562D 44 48 0 0 0 0 0 0 0 0999 V2000 0.3777 -3.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3766 -4.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0914 -4.5860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8078 -4.1727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 -3.3422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0896 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0833 -5.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6667 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4958 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5167 -2.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5125 -2.1000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8625 -1.5667 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3083 -1.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3042 -1.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0958 -2.6833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0375 -1.5625 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 1.0333 -0.7375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0333 -2.3875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2125 -1.5583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0224 -2.2668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1995 -2.2678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1983 -0.8433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4357 -1.5479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.8382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4268 -0.1255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2490 -0.1213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6628 -0.8357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2537 -1.5455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0208 -2.2958 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 4.4292 -1.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4292 -3.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2542 -1.5792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.2542 -3.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6625 -2.2917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6625 -0.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2458 -0.1458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4875 -0.8625 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0708 -0.2750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8667 -0.4875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0782 -1.2847 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8732 -1.4974 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4560 -0.9141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2385 -0.1152 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4439 0.0937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21 19 1 0 0 0 0 2 3 1 0 0 0 0 24 22 1 0 0 0 0 10 11 1 6 0 0 0 5 6 2 0 0 0 0 23 24 1 0 0 0 0 11 12 1 0 0 0 0 24 25 2 0 0 0 0 6 1 1 0 0 0 0 25 26 1 0 0 0 0 11 13 1 0 0 0 0 26 27 2 0 0 0 0 1 2 2 0 0 0 0 27 28 1 0 0 0 0 28 23 2 0 0 0 0 13 14 2 0 0 0 0 13 29 1 0 0 0 0 3 7 1 0 0 0 0 29 30 1 0 0 0 0 11 15 1 1 0 0 0 29 31 1 0 0 0 0 3 4 2 0 0 0 0 30 32 1 0 0 0 0 12 16 1 0 0 0 0 31 33 1 0 0 0 0 7 8 1 0 0 0 0 32 34 1 0 0 0 0 33 34 1 0 0 0 0 16 17 2 0 0 0 0 32 35 1 1 0 0 0 35 36 2 0 0 0 0 16 18 2 0 0 0 0 35 37 1 0 0 0 0 7 9 2 0 0 0 0 37 38 1 0 0 0 0 16 19 1 0 0 0 0 38 39 1 0 0 0 0 19 22 2 0 0 0 0 39 40 2 0 0 0 0 4 5 1 0 0 0 0 40 41 1 0 0 0 0 23 20 1 0 0 0 0 41 42 2 0 0 0 0 5 10 1 0 0 0 0 42 43 1 0 0 0 0 20 21 2 0 0 0 0 43 44 2 0 0 0 0 44 39 1 0 0 0 0 M END $$$$ -ISIS- 04110309232D 37 41 0 0 0 0 0 0 0 0999 V2000 4.0220 -2.2961 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 4.2345 -3.0919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0570 -3.1358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3530 -2.3670 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7132 -1.8481 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.3777 -3.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3766 -4.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0914 -4.5860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8078 -4.1727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 -3.3422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0896 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0833 -5.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6667 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4958 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5167 -2.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5125 -2.1000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8625 -1.5667 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3083 -1.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3042 -1.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0958 -2.6833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0375 -1.5625 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 1.0333 -0.7375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0333 -2.3875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2125 -1.5625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1981 -0.8457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0188 -2.2772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1959 -2.2740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4357 -1.5604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0221 -0.8471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.1344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2573 -0.1338 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6690 -0.8518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2557 -1.5616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1458 -2.1500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9250 -1.0458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7500 -1.0458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3333 -1.6292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4 5 1 0 0 0 0 18 19 2 0 0 0 0 9 10 1 0 0 0 0 16 20 1 1 0 0 0 5 1 1 0 0 0 0 17 21 1 0 0 0 0 10 11 2 0 0 0 0 21 22 2 0 0 0 0 11 6 1 0 0 0 0 21 23 2 0 0 0 0 1 2 1 0 0 0 0 21 24 1 0 0 0 0 8 12 1 0 0 0 0 24 25 2 0 0 0 0 25 29 1 0 0 0 0 28 26 1 0 0 0 0 12 13 1 0 0 0 0 26 27 2 0 0 0 0 27 24 1 0 0 0 0 6 7 2 0 0 0 0 12 14 2 0 0 0 0 28 29 1 0 0 0 0 2 3 1 0 0 0 0 29 30 2 0 0 0 0 10 15 1 0 0 0 0 30 31 1 0 0 0 0 7 8 1 0 0 0 0 31 32 2 0 0 0 0 15 16 1 6 0 0 0 32 33 1 0 0 0 0 33 28 2 0 0 0 0 18 1 1 0 0 0 0 3 4 1 0 0 0 0 4 34 1 1 0 0 0 16 17 1 0 0 0 0 5 35 1 6 0 0 0 8 9 2 0 0 0 0 35 36 1 0 0 0 0 16 18 1 0 0 0 0 36 37 1 0 0 0 0 37 34 1 0 0 0 0 M END $$$$ -ISIS- 04110308352D 35 38 0 0 0 0 0 0 0 0999 V2000 0.3777 -3.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3766 -4.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0914 -4.5860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8078 -4.1727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 -3.3422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0896 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0833 -5.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6667 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4958 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5167 -2.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5125 -2.1000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8625 -1.5667 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3083 -1.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3042 -1.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0208 -2.2958 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 3.0958 -2.6833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0375 -1.5625 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 1.0333 -0.7375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0333 -2.3875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2125 -1.5583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4357 -1.5479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0224 -2.2668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1995 -2.2678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0187 -0.8350 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1983 -0.8433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2173 -0.1381 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1863 0.5760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0099 0.5804 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4218 -0.1255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4292 -1.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4292 -3.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2542 -1.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2542 -3.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6625 -2.2917 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.4875 -2.2917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17 18 2 0 0 0 0 7 9 2 0 0 0 0 17 19 2 0 0 0 0 4 5 1 0 0 0 0 17 20 1 0 0 0 0 20 25 2 0 0 0 0 5 10 1 0 0 0 0 24 21 2 0 0 0 0 2 3 1 0 0 0 0 21 22 1 0 0 0 0 10 11 1 6 0 0 0 22 23 2 0 0 0 0 23 20 1 0 0 0 0 5 6 2 0 0 0 0 11 12 1 0 0 0 0 24 25 1 0 0 0 0 6 1 1 0 0 0 0 25 26 1 0 0 0 0 11 13 1 0 0 0 0 26 27 2 0 0 0 0 1 2 2 0 0 0 0 27 28 1 0 0 0 0 13 14 2 0 0 0 0 28 29 2 0 0 0 0 29 24 1 0 0 0 0 3 7 1 0 0 0 0 15 30 1 0 0 0 0 13 15 1 0 0 0 0 15 31 1 0 0 0 0 3 4 2 0 0 0 0 30 32 1 0 0 0 0 11 16 1 1 0 0 0 31 33 1 0 0 0 0 7 8 1 0 0 0 0 32 34 1 0 0 0 0 33 34 1 0 0 0 0 12 17 1 0 0 0 0 34 35 1 0 0 0 0 M END $$$$ -ISIS- 04110309482D 31 33 0 0 0 0 0 0 0 0999 V2000 0.2117 -1.5586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3777 -3.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3766 -4.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0914 -4.5860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8078 -4.1727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 -3.3422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0896 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0833 -5.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6667 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4958 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5167 -2.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5125 -2.1000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8625 -1.5667 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3083 -1.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3042 -1.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0958 -2.6833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0375 -1.5625 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 1.0333 -0.7375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0333 -2.3875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1042 -2.0958 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 4.5125 -1.3792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3375 -1.3792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5125 -2.8083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3375 -2.8083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7458 -2.0917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1964 -0.8399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0214 -0.8357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4385 -1.5494 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0245 -2.2689 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2009 -2.2696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2667 -1.5417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12 16 1 1 0 0 0 4 5 2 0 0 0 0 13 17 1 0 0 0 0 8 9 1 0 0 0 0 17 18 2 0 0 0 0 17 19 2 0 0 0 0 8 10 2 0 0 0 0 14 20 1 0 0 0 0 5 6 1 0 0 0 0 20 21 1 0 0 0 0 6 11 1 0 0 0 0 21 22 1 0 0 0 0 22 25 1 0 0 0 0 3 4 1 0 0 0 0 20 23 1 0 0 0 0 11 12 1 6 0 0 0 23 24 1 0 0 0 0 6 7 2 0 0 0 0 24 25 1 0 0 0 0 17 1 1 0 0 0 0 12 13 1 0 0 0 0 1 26 2 0 0 0 0 7 2 1 0 0 0 0 26 27 1 0 0 0 0 12 14 1 0 0 0 0 27 28 2 0 0 0 0 2 3 2 0 0 0 0 28 29 1 0 0 0 0 14 15 2 0 0 0 0 29 30 2 0 0 0 0 30 1 1 0 0 0 0 4 8 1 0 0 0 0 28 31 1 0 0 0 0 M END $$$$ -ISIS- 04110309482D 30 32 0 0 0 0 0 0 0 0999 V2000 4.1064 -2.0998 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 4.5147 -2.8123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3186 -2.6441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4070 -1.8276 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6579 -1.4913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2117 -1.5586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3777 -3.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3766 -4.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0914 -4.5860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8078 -4.1727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 -3.3422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0896 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0833 -5.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6667 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4958 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5167 -2.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5125 -2.1000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8625 -1.5667 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3083 -1.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3042 -1.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0958 -2.6833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0375 -1.5625 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 1.0333 -0.7375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0333 -2.3875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1964 -0.8399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0214 -0.8357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4385 -1.5494 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0245 -2.2689 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2009 -2.2696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2667 -1.5417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3 4 1 0 0 0 0 11 16 1 0 0 0 0 8 9 1 0 0 0 0 16 17 1 6 0 0 0 4 5 1 0 0 0 0 17 18 1 0 0 0 0 9 10 2 0 0 0 0 17 19 1 0 0 0 0 5 1 1 0 0 0 0 19 20 2 0 0 0 0 10 11 1 0 0 0 0 17 21 1 1 0 0 0 1 2 1 0 0 0 0 18 22 1 0 0 0 0 11 12 2 0 0 0 0 22 23 2 0 0 0 0 12 7 1 0 0 0 0 22 24 2 0 0 0 0 19 1 1 0 0 0 0 22 6 1 0 0 0 0 6 25 2 0 0 0 0 9 13 1 0 0 0 0 25 26 1 0 0 0 0 2 3 1 0 0 0 0 26 27 2 0 0 0 0 13 14 1 0 0 0 0 27 28 1 0 0 0 0 7 8 2 0 0 0 0 28 29 2 0 0 0 0 29 6 1 0 0 0 0 13 15 2 0 0 0 0 27 30 1 0 0 0 0 M END $$$$ -ISIS- 04110308572D 39 42 0 0 0 0 0 0 0 0999 V2000 0.3777 -3.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3766 -4.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0914 -4.5860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8078 -4.1727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 -3.3422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0896 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0833 -5.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6667 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4958 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5167 -2.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5125 -2.1000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8625 -1.5667 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3083 -1.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3042 -1.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0958 -2.6833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0375 -1.5625 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 1.0333 -0.7375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0333 -2.3875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2125 -1.5583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0224 -2.2668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1995 -2.2678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1983 -0.8433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4357 -1.5479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.8382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4268 -0.1255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2490 -0.1213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6628 -0.8357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2537 -1.5455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0208 -2.2958 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 4.4292 -1.5792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.4292 -3.0083 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.2542 -1.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2542 -3.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6625 -2.2917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4250 -0.7542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8375 -0.1667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1375 -0.3375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3500 0.4625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0125 -3.7208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19 22 2 0 0 0 0 4 5 1 0 0 0 0 23 20 1 0 0 0 0 5 10 1 0 0 0 0 20 21 2 0 0 0 0 21 19 1 0 0 0 0 2 3 1 0 0 0 0 24 22 1 0 0 0 0 10 11 1 6 0 0 0 5 6 2 0 0 0 0 23 24 1 0 0 0 0 11 12 1 0 0 0 0 24 25 2 0 0 0 0 6 1 1 0 0 0 0 25 26 1 0 0 0 0 11 13 1 0 0 0 0 26 27 2 0 0 0 0 1 2 2 0 0 0 0 27 28 1 0 0 0 0 28 23 2 0 0 0 0 13 14 2 0 0 0 0 13 29 1 0 0 0 0 3 7 1 0 0 0 0 29 30 1 0 0 0 0 11 15 1 1 0 0 0 29 31 1 0 0 0 0 3 4 2 0 0 0 0 30 32 1 0 0 0 0 12 16 1 0 0 0 0 31 33 1 0 0 0 0 7 8 1 0 0 0 0 32 34 1 0 0 0 0 33 34 1 0 0 0 0 16 17 2 0 0 0 0 30 35 1 1 0 0 0 35 36 2 0 0 0 0 16 18 2 0 0 0 0 35 37 1 0 0 0 0 7 9 2 0 0 0 0 37 38 1 0 0 0 0 16 19 1 0 0 0 0 31 39 1 6 0 0 0 M END $$$$ -ISIS- 04110308582D 36 39 0 0 0 0 0 0 0 0999 V2000 0.3777 -3.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3766 -4.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0914 -4.5860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8078 -4.1727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 -3.3422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0896 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0833 -5.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6667 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4958 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5167 -2.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5125 -2.1000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8625 -1.5667 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3083 -1.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3042 -1.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0958 -2.6833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0375 -1.5625 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 1.0333 -0.7375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0333 -2.3875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2125 -1.5583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0224 -2.2668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1995 -2.2678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1983 -0.8433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4357 -1.5479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.8382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4268 -0.1255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2490 -0.1213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6628 -0.8357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2537 -1.5455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0208 -2.2958 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 4.4292 -1.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4292 -3.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2542 -1.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2542 -3.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6625 -2.2917 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 6.2458 -1.7042 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2458 -2.8750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16 18 2 0 0 0 0 7 9 2 0 0 0 0 16 19 1 0 0 0 0 19 22 2 0 0 0 0 4 5 1 0 0 0 0 23 20 1 0 0 0 0 5 10 1 0 0 0 0 20 21 2 0 0 0 0 21 19 1 0 0 0 0 2 3 1 0 0 0 0 24 22 1 0 0 0 0 10 11 1 6 0 0 0 5 6 2 0 0 0 0 23 24 1 0 0 0 0 11 12 1 0 0 0 0 24 25 2 0 0 0 0 6 1 1 0 0 0 0 25 26 1 0 0 0 0 11 13 1 0 0 0 0 26 27 2 0 0 0 0 1 2 2 0 0 0 0 27 28 1 0 0 0 0 28 23 2 0 0 0 0 13 14 2 0 0 0 0 13 29 1 0 0 0 0 3 7 1 0 0 0 0 29 30 1 0 0 0 0 11 15 1 1 0 0 0 29 31 1 0 0 0 0 3 4 2 0 0 0 0 30 32 1 0 0 0 0 12 16 1 0 0 0 0 31 33 1 0 0 0 0 7 8 1 0 0 0 0 32 34 1 0 0 0 0 33 34 1 0 0 0 0 16 17 2 0 0 0 0 34 35 1 0 0 0 0 34 36 1 0 0 0 0 M CHG 1 34 1 M END $$$$ -ISIS- 04110308592D 40 43 0 0 0 0 0 0 0 0999 V2000 0.3777 -3.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3766 -4.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0914 -4.5860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8078 -4.1727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 -3.3422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0896 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0833 -5.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6667 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4958 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5167 -2.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5125 -2.1000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8625 -1.5667 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3083 -1.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3042 -1.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0958 -2.6833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0375 -1.5625 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 1.0333 -0.7375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0333 -2.3875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2125 -1.5583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0224 -2.2668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1995 -2.2678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1983 -0.8433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4357 -1.5479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.8382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4268 -0.1255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2490 -0.1213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6628 -0.8357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2537 -1.5455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0208 -2.2958 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 4.4292 -1.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4292 -3.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2542 -1.5792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.2542 -3.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6625 -2.2917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6625 -0.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9458 -0.4500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4583 -0.6458 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6708 0.1542 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.2542 0.8708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3833 0.5708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4 5 1 0 0 0 0 23 20 1 0 0 0 0 5 10 1 0 0 0 0 20 21 2 0 0 0 0 21 19 1 0 0 0 0 2 3 1 0 0 0 0 24 22 1 0 0 0 0 10 11 1 6 0 0 0 5 6 2 0 0 0 0 23 24 1 0 0 0 0 11 12 1 0 0 0 0 24 25 2 0 0 0 0 6 1 1 0 0 0 0 25 26 1 0 0 0 0 11 13 1 0 0 0 0 26 27 2 0 0 0 0 1 2 2 0 0 0 0 27 28 1 0 0 0 0 28 23 2 0 0 0 0 13 14 2 0 0 0 0 13 29 1 0 0 0 0 3 7 1 0 0 0 0 29 30 1 0 0 0 0 11 15 1 1 0 0 0 29 31 1 0 0 0 0 3 4 2 0 0 0 0 30 32 1 0 0 0 0 12 16 1 0 0 0 0 31 33 1 0 0 0 0 7 8 1 0 0 0 0 32 34 1 0 0 0 0 33 34 1 0 0 0 0 16 17 2 0 0 0 0 32 35 1 1 0 0 0 35 36 2 0 0 0 0 16 18 2 0 0 0 0 35 37 1 0 0 0 0 7 9 2 0 0 0 0 37 38 1 0 0 0 0 16 19 1 0 0 0 0 38 39 1 0 0 0 0 19 22 2 0 0 0 0 38 40 1 0 0 0 0 M END $$$$ -ISIS- 04110309002D 37 40 0 0 0 0 0 0 0 0999 V2000 0.3777 -3.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3766 -4.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0914 -4.5860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8078 -4.1727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 -3.3422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0896 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0833 -5.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6667 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4958 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5167 -2.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5125 -2.1000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8625 -1.5667 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3083 -1.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3042 -1.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0958 -2.6833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0375 -1.5625 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 1.0333 -0.7375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0333 -2.3875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2125 -1.5583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0224 -2.2668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1995 -2.2678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1983 -0.8433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4357 -1.5479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.8382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4268 -0.1255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2490 -0.1213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6628 -0.8357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2537 -1.5455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0208 -2.2958 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 4.4292 -1.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4292 -3.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2542 -1.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2542 -3.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6625 -2.2917 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.4875 -2.2917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0708 -1.7042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7000 -3.0875 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 7 9 2 0 0 0 0 16 19 1 0 0 0 0 19 22 2 0 0 0 0 4 5 1 0 0 0 0 23 20 1 0 0 0 0 5 10 1 0 0 0 0 20 21 2 0 0 0 0 21 19 1 0 0 0 0 2 3 1 0 0 0 0 24 22 1 0 0 0 0 10 11 1 6 0 0 0 5 6 2 0 0 0 0 23 24 1 0 0 0 0 11 12 1 0 0 0 0 24 25 2 0 0 0 0 6 1 1 0 0 0 0 25 26 1 0 0 0 0 11 13 1 0 0 0 0 26 27 2 0 0 0 0 1 2 2 0 0 0 0 27 28 1 0 0 0 0 28 23 2 0 0 0 0 13 14 2 0 0 0 0 13 29 1 0 0 0 0 3 7 1 0 0 0 0 29 30 1 0 0 0 0 11 15 1 1 0 0 0 29 31 1 0 0 0 0 3 4 2 0 0 0 0 30 32 1 0 0 0 0 12 16 1 0 0 0 0 31 33 1 0 0 0 0 7 8 1 0 0 0 0 32 34 1 0 0 0 0 33 34 1 0 0 0 0 16 17 2 0 0 0 0 34 35 1 0 0 0 0 35 36 2 0 0 0 0 16 18 2 0 0 0 0 35 37 1 0 0 0 0 M CHG 1 37 -1 M END $$$$ -ISIS- 09220311052D 43 47 0 0 0 0 0 0 0 0999 V2000 1.9303 -0.9544 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 2.1428 -1.7502 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9653 -1.7941 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2613 -1.0253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6215 -0.5064 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.7140 -2.0041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7151 -2.8315 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0003 -3.2443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2839 -2.8310 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2867 -2.0005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 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0 0 0 0 0 0 0 0 0 -4.7607 0.4899 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3474 -0.2199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6166 0.3209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0291 0.9084 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4125 0.5375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6250 1.3375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4208 1.5542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0052 0.9706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8004 1.1868 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0112 1.9850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4208 2.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6279 2.3478 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 21 24 1 0 0 0 0 8 12 1 0 0 0 0 24 25 2 0 0 0 0 25 29 1 0 0 0 0 28 26 1 0 0 0 0 12 13 1 0 0 0 0 26 27 2 0 0 0 0 27 24 1 0 0 0 0 6 7 2 0 0 0 0 12 14 2 0 0 0 0 28 29 1 0 0 0 0 2 3 1 0 0 0 0 29 30 2 0 0 0 0 10 15 1 0 0 0 0 30 31 1 0 0 0 0 7 8 1 0 0 0 0 31 32 2 0 0 0 0 15 16 1 6 0 0 0 32 33 1 0 0 0 0 33 28 2 0 0 0 0 18 1 1 0 0 0 0 3 4 1 0 0 0 0 5 34 1 6 0 0 0 16 17 1 0 0 0 0 34 35 2 0 0 0 0 8 9 2 0 0 0 0 34 36 1 0 0 0 0 16 18 1 0 0 0 0 36 37 1 0 0 0 0 4 5 1 0 0 0 0 18 19 2 0 0 0 0 9 10 1 0 0 0 0 16 20 1 1 0 0 0 5 1 1 0 0 0 0 37 38 1 0 0 0 0 17 21 1 0 0 0 0 38 39 2 0 0 0 0 10 11 2 0 0 0 0 39 40 1 0 0 0 0 21 22 2 0 0 0 0 40 41 2 0 0 0 0 11 6 1 0 0 0 0 41 42 1 0 0 0 0 21 23 2 0 0 0 0 42 43 2 0 0 0 0 43 38 1 0 0 0 0 M END $$$$ -ISIS- 04110309242D 37 40 0 0 0 0 0 0 0 0999 V2000 4.0220 -2.2961 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 4.2345 -3.0919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0570 -3.1358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3530 -2.3670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7132 -1.8481 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.3777 -3.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3766 -4.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0914 -4.5860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8078 -4.1727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 -3.3422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0896 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0833 -5.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6667 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4958 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5167 -2.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5125 -2.1000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8625 -1.5667 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3083 -1.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3042 -1.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0958 -2.6833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0375 -1.5625 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 1.0333 -0.7375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0333 -2.3875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2125 -1.5625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1981 -0.8457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0188 -2.2772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1959 -2.2740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4357 -1.5604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0221 -0.8471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.1344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2573 -0.1338 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6690 -0.8518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2557 -1.5616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7083 -1.0208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1208 -0.4333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5042 -0.8042 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7167 -0.0042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4 5 1 0 0 0 0 18 19 2 0 0 0 0 9 10 1 0 0 0 0 16 20 1 1 0 0 0 5 1 1 0 0 0 0 17 21 1 0 0 0 0 10 11 2 0 0 0 0 21 22 2 0 0 0 0 11 6 1 0 0 0 0 21 23 2 0 0 0 0 1 2 1 0 0 0 0 21 24 1 0 0 0 0 8 12 1 0 0 0 0 24 25 2 0 0 0 0 25 29 1 0 0 0 0 28 26 1 0 0 0 0 12 13 1 0 0 0 0 26 27 2 0 0 0 0 27 24 1 0 0 0 0 6 7 2 0 0 0 0 12 14 2 0 0 0 0 28 29 1 0 0 0 0 2 3 1 0 0 0 0 29 30 2 0 0 0 0 10 15 1 0 0 0 0 30 31 1 0 0 0 0 7 8 1 0 0 0 0 31 32 2 0 0 0 0 15 16 1 6 0 0 0 32 33 1 0 0 0 0 33 28 2 0 0 0 0 18 1 1 0 0 0 0 3 4 1 0 0 0 0 5 34 1 6 0 0 0 16 17 1 0 0 0 0 34 35 2 0 0 0 0 8 9 2 0 0 0 0 34 36 1 0 0 0 0 16 18 1 0 0 0 0 36 37 1 0 0 0 0 M END $$$$ -ISIS- 09220311062D 48 53 0 0 0 0 0 0 0 0999 V2000 2.7553 -0.3669 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 -0.8890 -1.4166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8901 -2.2440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1753 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0 0 -2.2888 1.0821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6997 1.7948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5240 1.7954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9357 1.0774 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5224 0.3676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1625 0.3500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1625 -1.0791 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.9875 -1.0791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9862 0.3494 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3958 -0.3625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2152 -0.3627 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6259 0.3482 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2113 1.0607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3933 1.0574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7458 -1.7916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9208 -1.7875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1541 -2.5041 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7333 -3.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1417 -3.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7259 -4.6344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1335 -5.3464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9556 -5.3495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3683 -4.6346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9583 -3.9255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7 2 1 0 0 0 0 26 27 1 0 0 0 0 12 14 1 0 0 0 0 27 28 2 0 0 0 0 2 3 2 0 0 0 0 28 29 1 0 0 0 0 29 24 2 0 0 0 0 14 1 1 0 0 0 0 14 15 2 0 0 0 0 1 30 1 0 0 0 0 4 8 1 0 0 0 0 1 31 1 0 0 0 0 30 33 1 0 0 0 0 34 32 1 0 0 0 0 12 16 1 1 0 0 0 31 32 1 0 0 0 0 4 5 2 0 0 0 0 13 17 1 0 0 0 0 33 34 2 0 0 0 0 8 9 1 0 0 0 0 34 35 1 0 0 0 0 17 18 2 0 0 0 0 35 36 2 0 0 0 0 36 37 1 0 0 0 0 17 19 2 0 0 0 0 37 38 2 0 0 0 0 38 33 1 0 0 0 0 8 10 2 0 0 0 0 31 39 1 6 0 0 0 17 20 1 0 0 0 0 39 40 2 0 0 0 0 5 6 1 0 0 0 0 39 41 1 0 0 0 0 20 21 2 0 0 0 0 21 25 1 0 0 0 0 6 11 1 0 0 0 0 24 22 1 0 0 0 0 3 4 1 0 0 0 0 22 23 2 0 0 0 0 41 42 1 0 0 0 0 23 20 1 0 0 0 0 42 43 1 0 0 0 0 11 12 1 6 0 0 0 43 44 2 0 0 0 0 6 7 2 0 0 0 0 44 45 1 0 0 0 0 24 25 1 0 0 0 0 45 46 2 0 0 0 0 12 13 1 0 0 0 0 46 47 1 0 0 0 0 25 26 2 0 0 0 0 47 48 2 0 0 0 0 48 43 1 0 0 0 0 M END $$$$ -ISIS- 04110309502D 49 52 0 0 0 0 0 0 0 0999 V2000 4.1042 -2.0958 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 4.3167 -2.8917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1077 -3.1044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6919 -2.5245 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4794 -1.7286 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.6827 -1.5127 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2117 -1.5586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3777 -3.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3766 -4.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0914 -4.5860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8078 -4.1727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 -3.3422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0896 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0833 -5.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6667 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4958 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5167 -2.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5125 -2.1000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8625 -1.5667 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3083 -1.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3042 -1.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0958 -2.6833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0375 -1.5625 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 1.0333 -0.7375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0333 -2.3875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1964 -0.8399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0214 -0.8357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4385 -1.5494 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0245 -2.2689 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2009 -2.2696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2667 -1.5417 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.8542 -0.9542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6833 -2.2542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2042 -0.0125 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3792 0.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7917 0.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2083 -3.0917 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0042 -3.8875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9250 -3.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0625 -1.1375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0583 -0.3125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8583 -1.3500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5708 -0.9333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2833 -1.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2796 -2.1702 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9912 -2.5826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7057 -2.1718 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7040 -1.3442 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9918 -0.9355 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23 25 2 0 0 0 0 20 1 1 0 0 0 0 23 7 1 0 0 0 0 13 8 1 0 0 0 0 7 26 2 0 0 0 0 26 27 1 0 0 0 0 10 14 1 0 0 0 0 27 28 2 0 0 0 0 1 2 1 0 0 0 0 28 29 1 0 0 0 0 14 15 1 0 0 0 0 29 30 2 0 0 0 0 30 7 1 0 0 0 0 1 6 1 0 0 0 0 28 31 1 0 0 0 0 14 16 2 0 0 0 0 31 32 1 0 0 0 0 8 9 2 0 0 0 0 31 33 1 0 0 0 0 12 17 1 0 0 0 0 26 34 1 0 0 0 0 2 3 1 0 0 0 0 34 35 1 0 0 0 0 17 18 1 6 0 0 0 34 36 1 0 0 0 0 9 10 1 0 0 0 0 30 37 1 0 0 0 0 18 19 1 0 0 0 0 37 38 1 0 0 0 0 3 4 1 0 0 0 0 37 39 1 0 0 0 0 18 20 1 0 0 0 0 5 40 1 1 0 0 0 10 11 2 0 0 0 0 40 41 2 0 0 0 0 20 21 2 0 0 0 0 40 42 1 0 0 0 0 4 5 1 0 0 0 0 42 43 1 0 0 0 0 18 22 1 1 0 0 0 43 44 1 0 0 0 0 11 12 1 0 0 0 0 44 45 2 0 0 0 0 19 23 1 0 0 0 0 45 46 1 0 0 0 0 5 6 1 0 0 0 0 46 47 2 0 0 0 0 23 24 2 0 0 0 0 47 48 1 0 0 0 0 12 13 2 0 0 0 0 48 49 2 0 0 0 0 49 44 1 0 0 0 0 M END $$$$ -ISIS- 04110309292D 37 40 0 0 0 0 0 0 0 0999 V2000 4.0220 -2.2961 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 0.3777 -3.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3766 -4.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0914 -4.5860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8078 -4.1727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 -3.3422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0896 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0833 -5.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6667 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4958 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5167 -2.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5125 -2.1000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8625 -1.5667 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3083 -1.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3042 -1.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0958 -2.6833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0375 -1.5625 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 1.0333 -0.7375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0333 -2.3875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2125 -1.5625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1981 -0.8457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0188 -2.2772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1959 -2.2740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4357 -1.5604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0221 -0.8471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.1344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2573 -0.1338 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6690 -0.8518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2557 -1.5616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4292 -1.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4292 -3.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2542 -1.5792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.6625 -2.2917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2542 -3.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6625 -0.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9458 -0.4500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4583 -0.6458 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 17 19 2 0 0 0 0 8 10 2 0 0 0 0 17 20 1 0 0 0 0 5 6 1 0 0 0 0 20 21 2 0 0 0 0 21 25 1 0 0 0 0 6 11 1 0 0 0 0 24 22 1 0 0 0 0 3 4 1 0 0 0 0 22 23 2 0 0 0 0 23 20 1 0 0 0 0 11 12 1 6 0 0 0 6 7 2 0 0 0 0 24 25 1 0 0 0 0 12 13 1 0 0 0 0 25 26 2 0 0 0 0 7 2 1 0 0 0 0 26 27 1 0 0 0 0 12 14 1 0 0 0 0 27 28 2 0 0 0 0 2 3 2 0 0 0 0 28 29 1 0 0 0 0 29 24 2 0 0 0 0 14 1 1 0 0 0 0 14 15 2 0 0 0 0 1 30 1 0 0 0 0 4 8 1 0 0 0 0 1 31 1 0 0 0 0 12 16 1 1 0 0 0 30 32 1 0 0 0 0 4 5 2 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 13 17 1 0 0 0 0 31 34 1 0 0 0 0 8 9 1 0 0 0 0 32 35 1 1 0 0 0 17 18 2 0 0 0 0 35 36 2 0 0 0 0 35 37 1 0 0 0 0 M CHG 1 37 -1 M END $$$$ -ISIS- 04110309522D 29 30 0 0 0 0 0 0 0 0999 V2000 4.1042 -2.0958 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 4.3167 -2.8917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1077 -3.1044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6919 -2.5245 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.4794 -1.7286 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6827 -1.5127 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3777 -3.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3766 -4.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0914 -4.5860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8078 -4.1727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 -3.3422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0896 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0833 -5.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6667 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4958 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5167 -2.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5125 -2.1000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8625 -1.5667 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3083 -1.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3042 -1.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0958 -2.6833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4875 -2.7333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0375 -1.5667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0333 -2.3917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3208 -1.1542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2667 -0.5667 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3167 0.0208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8542 -1.1500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8542 0.0208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 13 15 2 0 0 0 0 7 8 2 0 0 0 0 11 16 1 0 0 0 0 1 6 1 0 0 0 0 16 17 1 6 0 0 0 8 9 1 0 0 0 0 17 18 1 0 0 0 0 2 3 1 0 0 0 0 17 19 1 0 0 0 0 9 10 2 0 0 0 0 19 20 2 0 0 0 0 3 4 1 0 0 0 0 17 21 1 1 0 0 0 19 1 1 0 0 0 0 10 11 1 0 0 0 0 4 22 1 0 0 0 0 4 5 1 0 0 0 0 18 23 1 0 0 0 0 11 12 2 0 0 0 0 23 24 2 0 0 0 0 12 7 1 0 0 0 0 23 25 1 0 0 0 0 5 6 1 0 0 0 0 25 26 1 0 0 0 0 9 13 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 13 14 1 0 0 0 0 26 29 1 0 0 0 0 M END $$$$ -ISIS- 04110309572D 49 52 0 0 0 0 0 0 0 0999 V2000 4.1042 -2.0958 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 4.3167 -2.8917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1077 -3.1044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6919 -2.5245 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4794 -1.7286 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.6827 -1.5127 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3777 -3.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3766 -4.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0914 -4.5860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8078 -4.1727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 -3.3422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0896 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0833 -5.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6667 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4958 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5167 -2.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5125 -2.1000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.3083 -1.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3042 -1.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0958 -2.6833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0625 -1.1375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4750 -0.5500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8875 -1.1375 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.4708 -0.5500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2958 -0.5500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7065 -1.2668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5307 -1.2671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9440 -0.5521 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5271 0.1647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7042 0.1615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9833 -1.4125 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1833 -1.6250 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 1.1792 -0.8000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1792 -2.4500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3583 -1.6208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0487 -0.9020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8729 -0.8975 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2898 -1.6104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8765 -2.3293 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0536 -2.3303 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1167 -1.6042 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.8333 -1.1917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8333 -2.0125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1625 -0.1000 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.0542 0.7000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7458 0.4875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2708 -3.1250 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.0583 -3.9208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6875 -3.8375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23 24 1 0 0 0 0 12 7 1 0 0 0 0 24 25 1 0 0 0 0 5 6 1 0 0 0 0 25 26 2 0 0 0 0 9 13 1 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 13 14 1 0 0 0 0 28 29 1 0 0 0 0 1 2 1 0 0 0 0 29 30 2 0 0 0 0 30 25 1 0 0 0 0 13 15 2 0 0 0 0 17 31 1 0 0 0 0 7 8 2 0 0 0 0 31 32 1 0 0 0 0 11 16 1 0 0 0 0 32 33 2 0 0 0 0 1 6 1 0 0 0 0 32 34 2 0 0 0 0 16 17 1 6 0 0 0 32 35 1 0 0 0 0 8 9 1 0 0 0 0 35 36 2 0 0 0 0 17 18 1 0 0 0 0 36 37 1 0 0 0 0 2 3 1 0 0 0 0 37 38 2 0 0 0 0 18 19 2 0 0 0 0 38 39 1 0 0 0 0 9 10 2 0 0 0 0 39 40 2 0 0 0 0 40 35 1 0 0 0 0 17 20 1 1 0 0 0 38 41 1 0 0 0 0 18 1 1 0 0 0 0 41 42 1 0 0 0 0 3 4 1 0 0 0 0 41 43 1 0 0 0 0 5 21 1 1 0 0 0 36 44 1 0 0 0 0 10 11 1 0 0 0 0 44 45 1 0 0 0 0 21 22 2 0 0 0 0 44 46 1 0 0 0 0 4 5 1 0 0 0 0 40 47 1 0 0 0 0 21 23 1 0 0 0 0 47 48 1 0 0 0 0 11 12 2 0 0 0 0 47 49 1 0 0 0 0 M END $$$$ -ISIS- 04110309012D 43 47 0 0 0 0 0 0 0 0999 V2000 0.3777 -3.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3766 -4.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0914 -4.5860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8078 -4.1727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 -3.3422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0896 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0833 -5.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6667 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4958 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5167 -2.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5125 -2.1000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8625 -1.5667 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3083 -1.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3042 -1.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0958 -2.6833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0375 -1.5625 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 1.0333 -0.7375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0333 -2.3875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2125 -1.5583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0224 -2.2668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1995 -2.2678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1983 -0.8433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4357 -1.5479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.8382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4268 -0.1255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2490 -0.1213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6628 -0.8357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2537 -1.5455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0208 -2.2958 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 4.4292 -1.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4292 -3.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2542 -1.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2542 -3.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6625 -2.2917 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.4875 -2.2917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4833 -3.1167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3125 -2.2917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1375 -2.2917 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.5488 -3.0080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3702 -3.0099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7865 -2.2973 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3753 -1.5810 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5476 -1.5773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20 21 2 0 0 0 0 21 19 1 0 0 0 0 2 3 1 0 0 0 0 24 22 1 0 0 0 0 10 11 1 6 0 0 0 5 6 2 0 0 0 0 23 24 1 0 0 0 0 11 12 1 0 0 0 0 24 25 2 0 0 0 0 6 1 1 0 0 0 0 25 26 1 0 0 0 0 11 13 1 0 0 0 0 26 27 2 0 0 0 0 1 2 2 0 0 0 0 27 28 1 0 0 0 0 28 23 2 0 0 0 0 13 14 2 0 0 0 0 13 29 1 0 0 0 0 3 7 1 0 0 0 0 29 30 1 0 0 0 0 11 15 1 1 0 0 0 29 31 1 0 0 0 0 3 4 2 0 0 0 0 30 32 1 0 0 0 0 12 16 1 0 0 0 0 31 33 1 0 0 0 0 7 8 1 0 0 0 0 32 34 1 0 0 0 0 33 34 1 0 0 0 0 16 17 2 0 0 0 0 34 35 1 0 0 0 0 35 36 2 0 0 0 0 16 18 2 0 0 0 0 35 37 1 0 0 0 0 7 9 2 0 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 16 19 1 0 0 0 0 19 22 2 0 0 0 0 4 5 1 0 0 0 0 23 20 1 0 0 0 0 5 10 1 0 0 0 0 38 43 1 0 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 41 42 1 0 0 0 0 42 43 1 0 0 0 0 M END $$$$ -ISIS- 04110309022D 38 41 0 0 0 0 0 0 0 0999 V2000 0.3777 -3.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3766 -4.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0914 -4.5860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8078 -4.1727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 -3.3422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0896 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0833 -5.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6667 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4958 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5167 -2.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5125 -2.1000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8625 -1.5667 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3083 -1.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3042 -1.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0958 -2.6833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0375 -1.5625 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 1.0333 -0.7375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0333 -2.3875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2125 -1.5583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0224 -2.2668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1995 -2.2678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1983 -0.8433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4357 -1.5479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.8382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4268 -0.1255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2490 -0.1213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6628 -0.8357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2537 -1.5455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0208 -2.2958 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 4.4292 -1.5792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.4292 -3.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2542 -1.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2542 -3.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6625 -2.2917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4250 -0.7542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7083 -0.3417 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1375 -0.3375 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5458 0.3792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16 19 1 0 0 0 0 19 22 2 0 0 0 0 4 5 1 0 0 0 0 23 20 1 0 0 0 0 5 10 1 0 0 0 0 20 21 2 0 0 0 0 21 19 1 0 0 0 0 2 3 1 0 0 0 0 24 22 1 0 0 0 0 10 11 1 6 0 0 0 5 6 2 0 0 0 0 23 24 1 0 0 0 0 11 12 1 0 0 0 0 24 25 2 0 0 0 0 6 1 1 0 0 0 0 25 26 1 0 0 0 0 11 13 1 0 0 0 0 26 27 2 0 0 0 0 1 2 2 0 0 0 0 27 28 1 0 0 0 0 28 23 2 0 0 0 0 13 14 2 0 0 0 0 13 29 1 0 0 0 0 3 7 1 0 0 0 0 29 30 1 0 0 0 0 11 15 1 1 0 0 0 29 31 1 0 0 0 0 3 4 2 0 0 0 0 30 32 1 0 0 0 0 12 16 1 0 0 0 0 31 33 1 0 0 0 0 7 8 1 0 0 0 0 32 34 1 0 0 0 0 33 34 1 0 0 0 0 16 17 2 0 0 0 0 30 35 1 1 0 0 0 35 36 2 0 0 0 0 16 18 2 0 0 0 0 35 37 1 0 0 0 0 7 9 2 0 0 0 0 37 38 1 0 0 0 0 M END $$$$ -ISIS- 04110309252D 36 39 0 0 0 0 0 0 0 0999 V2000 4.0220 -2.2961 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 4.2345 -3.0919 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0570 -3.1358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3530 -2.3670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7132 -1.8481 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.3777 -3.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3766 -4.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0914 -4.5860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8078 -4.1727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 -3.3422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0896 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0833 -5.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6667 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4958 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5167 -2.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5125 -2.1000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8625 -1.5667 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3083 -1.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3042 -1.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0958 -2.6833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0375 -1.5625 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 1.0333 -0.7375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0333 -2.3875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2125 -1.5625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1981 -0.8457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0188 -2.2772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1959 -2.2740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4357 -1.5604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0221 -0.8471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.1344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2573 -0.1338 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6690 -0.8518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2557 -1.5616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7083 -1.0208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1208 -0.4333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5042 -0.8042 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 16 18 1 0 0 0 0 4 5 1 0 0 0 0 18 19 2 0 0 0 0 9 10 1 0 0 0 0 16 20 1 1 0 0 0 5 1 1 0 0 0 0 17 21 1 0 0 0 0 10 11 2 0 0 0 0 21 22 2 0 0 0 0 11 6 1 0 0 0 0 21 23 2 0 0 0 0 1 2 1 0 0 0 0 21 24 1 0 0 0 0 8 12 1 0 0 0 0 24 25 2 0 0 0 0 25 29 1 0 0 0 0 28 26 1 0 0 0 0 12 13 1 0 0 0 0 26 27 2 0 0 0 0 27 24 1 0 0 0 0 6 7 2 0 0 0 0 12 14 2 0 0 0 0 28 29 1 0 0 0 0 2 3 1 0 0 0 0 29 30 2 0 0 0 0 10 15 1 0 0 0 0 30 31 1 0 0 0 0 7 8 1 0 0 0 0 31 32 2 0 0 0 0 15 16 1 6 0 0 0 32 33 1 0 0 0 0 33 28 2 0 0 0 0 18 1 1 0 0 0 0 3 4 1 0 0 0 0 5 34 1 6 0 0 0 16 17 1 0 0 0 0 34 35 2 0 0 0 0 8 9 2 0 0 0 0 34 36 1 0 0 0 0 M CHG 1 36 -1 M END $$$$ -ISIS- 04110309032D 44 48 0 0 0 0 0 0 0 0999 V2000 0.3777 -3.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3766 -4.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0914 -4.5860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8078 -4.1727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 -3.3422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0896 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0833 -5.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6667 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4958 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5167 -2.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5125 -2.1000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8625 -1.5667 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3083 -1.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3042 -1.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0958 -2.6833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0375 -1.5625 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 1.0333 -0.7375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0333 -2.3875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2125 -1.5583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0224 -2.2668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1995 -2.2678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1983 -0.8433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4357 -1.5479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.8382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4268 -0.1255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2490 -0.1213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6628 -0.8357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2537 -1.5455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0208 -2.2958 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 4.4292 -1.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4292 -3.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2542 -1.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2542 -3.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6625 -2.2917 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.3750 -1.8750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3708 -1.0500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0875 -2.2875 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.8000 -1.8708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5125 -2.2833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5087 -3.1077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2204 -3.5201 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9349 -3.1093 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9332 -2.2817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2210 -1.8730 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21 19 1 0 0 0 0 2 3 1 0 0 0 0 24 22 1 0 0 0 0 10 11 1 6 0 0 0 5 6 2 0 0 0 0 23 24 1 0 0 0 0 11 12 1 0 0 0 0 24 25 2 0 0 0 0 6 1 1 0 0 0 0 25 26 1 0 0 0 0 11 13 1 0 0 0 0 26 27 2 0 0 0 0 1 2 2 0 0 0 0 27 28 1 0 0 0 0 28 23 2 0 0 0 0 13 14 2 0 0 0 0 13 29 1 0 0 0 0 3 7 1 0 0 0 0 29 30 1 0 0 0 0 11 15 1 1 0 0 0 29 31 1 0 0 0 0 3 4 2 0 0 0 0 30 32 1 0 0 0 0 12 16 1 0 0 0 0 31 33 1 0 0 0 0 7 8 1 0 0 0 0 32 34 1 0 0 0 0 33 34 1 0 0 0 0 16 17 2 0 0 0 0 34 35 1 0 0 0 0 35 36 2 0 0 0 0 16 18 2 0 0 0 0 35 37 1 0 0 0 0 7 9 2 0 0 0 0 37 38 1 0 0 0 0 16 19 1 0 0 0 0 38 39 1 0 0 0 0 19 22 2 0 0 0 0 39 40 2 0 0 0 0 4 5 1 0 0 0 0 40 41 1 0 0 0 0 23 20 1 0 0 0 0 41 42 2 0 0 0 0 5 10 1 0 0 0 0 42 43 1 0 0 0 0 20 21 2 0 0 0 0 43 44 2 0 0 0 0 44 39 1 0 0 0 0 M END $$$$ -ISIS- 09220311092D 35 37 0 0 0 0 0 0 0 0999 V2000 1.1284 -1.5044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4139 -1.0918 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4215 -2.7398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1311 -2.3251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2944 -3.2916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2933 -4.1190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0081 -4.5318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7245 -4.1185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7217 -3.2880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0063 -2.8788 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -5.3541 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5834 -5.9375 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4125 -5.9375 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4334 -2.8708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4292 -2.0458 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.7792 -1.5125 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2250 -1.8291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2209 -1.0041 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0125 -2.6291 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9542 -1.5083 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 1.9500 -0.6833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9500 -2.3333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0209 -2.0416 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2977 -2.3291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3016 -1.4998 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0178 -1.0909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0100 -2.7494 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7307 -2.3359 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7334 -1.5067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4084 -0.2666 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4167 -3.5625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5333 -2.5458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7375 -3.1583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7125 -2.9083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7333 -1.6208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4 1 1 0 0 0 0 16 20 1 0 0 0 0 9 10 2 0 0 0 0 20 21 2 0 0 0 0 10 5 1 0 0 0 0 20 22 2 0 0 0 0 2 25 1 0 0 0 0 17 23 1 0 0 0 0 7 11 1 0 0 0 0 11 12 1 0 0 0 0 5 6 2 0 0 0 0 11 13 2 0 0 0 0 24 3 1 0 0 0 0 20 1 1 0 0 0 0 24 25 2 0 0 0 0 9 14 1 0 0 0 0 6 7 1 0 0 0 0 14 15 1 6 0 0 0 1 2 2 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 26 29 1 0 0 0 0 28 27 1 0 0 0 0 15 16 1 0 0 0 0 7 8 2 0 0 0 0 28 29 1 0 0 0 0 15 17 1 0 0 0 0 2 30 1 0 0 0 0 3 4 2 0 0 0 0 3 31 1 0 0 0 0 17 18 2 0 0 0 0 28 32 1 0 0 0 0 8 9 1 0 0 0 0 28 33 1 0 0 0 0 15 19 1 1 0 0 0 4 34 1 0 0 0 0 23 35 1 0 0 0 0 M END $$$$ -ISIS- 04110309322D 30 32 0 0 0 0 0 0 0 0999 V2000 4.0220 -2.2961 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3777 -3.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3766 -4.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0914 -4.5860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8078 -4.1727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 -3.3422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0896 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0833 -5.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6667 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4958 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5167 -2.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5125 -2.1000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8625 -1.5667 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3083 -1.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3042 -1.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0958 -2.6833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0375 -1.5625 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 1.0333 -0.7375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0333 -2.3875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2125 -1.5625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1981 -0.8457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0188 -2.2772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1959 -2.2740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4357 -1.5604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0221 -0.8471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.1344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2573 -0.1338 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6690 -0.8518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2557 -1.5616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7333 -1.8792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4 8 1 0 0 0 0 12 16 1 1 0 0 0 4 5 2 0 0 0 0 13 17 1 0 0 0 0 8 9 1 0 0 0 0 17 18 2 0 0 0 0 17 19 2 0 0 0 0 8 10 2 0 0 0 0 17 20 1 0 0 0 0 5 6 1 0 0 0 0 20 21 2 0 0 0 0 21 25 1 0 0 0 0 6 11 1 0 0 0 0 24 22 1 0 0 0 0 3 4 1 0 0 0 0 22 23 2 0 0 0 0 23 20 1 0 0 0 0 11 12 1 6 0 0 0 6 7 2 0 0 0 0 24 25 1 0 0 0 0 12 13 1 0 0 0 0 25 26 2 0 0 0 0 7 2 1 0 0 0 0 26 27 1 0 0 0 0 12 14 1 0 0 0 0 27 28 2 0 0 0 0 2 3 2 0 0 0 0 28 29 1 0 0 0 0 29 24 2 0 0 0 0 14 1 1 0 0 0 0 14 15 2 0 0 0 0 1 30 1 0 0 0 0 M END $$$$ -ISIS- 09220311102D 32 34 0 0 0 0 0 0 0 0999 V2000 2.0553 0.7247 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5890 -0.3250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5901 -1.1524 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8753 -1.5652 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1589 -1.1519 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1617 -0.3214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8771 0.0878 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8834 -2.3875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3000 -2.9709 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4709 -2.9709 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5500 0.0958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5458 0.9208 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.1042 1.4541 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3416 1.1375 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3375 1.9625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1291 0.3375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9292 1.4583 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 -0.9334 2.2833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9334 0.6333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7542 1.4583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1648 2.1751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9855 0.7436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1626 0.7468 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4024 1.4604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9888 2.1737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3997 2.8864 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2240 2.8870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6357 2.1690 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2224 1.4592 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7666 1.1416 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 2.9750 1.9417 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4750 0.7292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12 16 1 1 0 0 0 4 5 2 0 0 0 0 13 17 1 0 0 0 0 8 9 1 0 0 0 0 17 18 2 0 0 0 0 17 19 2 0 0 0 0 8 10 2 0 0 0 0 17 20 1 0 0 0 0 5 6 1 0 0 0 0 20 21 2 0 0 0 0 21 25 1 0 0 0 0 6 11 1 0 0 0 0 24 22 1 0 0 0 0 3 4 1 0 0 0 0 22 23 2 0 0 0 0 23 20 1 0 0 0 0 11 12 1 6 0 0 0 6 7 2 0 0 0 0 24 25 1 0 0 0 0 12 13 1 0 0 0 0 25 26 2 0 0 0 0 7 2 1 0 0 0 0 26 27 1 0 0 0 0 12 14 1 0 0 0 0 27 28 2 0 0 0 0 2 3 2 0 0 0 0 28 29 1 0 0 0 0 29 24 2 0 0 0 0 14 1 1 0 0 0 0 14 15 2 0 0 0 0 1 30 1 0 0 0 0 30 31 1 0 0 0 0 4 8 1 0 0 0 0 30 32 1 0 0 0 0 M END $$$$ -ISIS- 04110310052D 42 44 0 0 0 0 0 0 0 0999 V2000 0.3777 -3.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3766 -4.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0914 -4.5860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8078 -4.1727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 -3.3422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0896 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0833 -5.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6667 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4958 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5167 -2.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5125 -2.1000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.3083 -1.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3042 -1.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0958 -2.6833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9250 -1.5125 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1000 -1.5125 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 1.0958 -2.3375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0958 -0.6875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0208 -2.2958 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 4.4292 -1.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2542 -1.5792 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.6625 -2.2917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2458 -3.0042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4208 -3.0042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6625 -0.8625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9458 -0.4500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4583 -0.6458 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 0.2750 -1.5083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1320 -0.7895 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9562 -0.7850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3732 -1.4979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9599 -2.2168 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1370 -2.2178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2000 -1.4958 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.7875 -0.9083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6167 -2.2083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1375 0.0375 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4458 0.6250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7250 0.6250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1417 -3.0417 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7292 -3.6250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1458 -3.8667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20 21 1 0 0 0 0 2 3 1 0 0 0 0 21 22 1 0 0 0 0 10 11 1 6 0 0 0 22 23 1 0 0 0 0 5 6 2 0 0 0 0 23 24 1 0 0 0 0 24 19 1 0 0 0 0 11 12 1 0 0 0 0 21 25 1 1 0 0 0 6 1 1 0 0 0 0 25 26 2 0 0 0 0 12 13 2 0 0 0 0 25 27 1 0 0 0 0 1 2 2 0 0 0 0 16 28 1 0 0 0 0 11 14 1 1 0 0 0 28 29 2 0 0 0 0 3 7 1 0 0 0 0 29 30 1 0 0 0 0 11 15 1 0 0 0 0 30 31 2 0 0 0 0 3 4 2 0 0 0 0 31 32 1 0 0 0 0 15 16 1 0 0 0 0 32 33 2 0 0 0 0 33 28 1 0 0 0 0 7 8 1 0 0 0 0 31 34 1 0 0 0 0 16 17 2 0 0 0 0 34 35 1 0 0 0 0 34 36 1 0 0 0 0 16 18 2 0 0 0 0 29 37 1 0 0 0 0 7 9 2 0 0 0 0 37 38 1 0 0 0 0 12 19 1 0 0 0 0 37 39 1 0 0 0 0 4 5 1 0 0 0 0 33 40 1 0 0 0 0 19 20 1 0 0 0 0 40 41 1 0 0 0 0 5 10 1 0 0 0 0 40 42 1 0 0 0 0 M CHG 1 27 -1 M END $$$$ -ISIS- 04110310062D 27 28 0 0 0 0 0 0 0 0999 V2000 0.3777 -3.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3766 -4.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0914 -4.5860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8078 -4.1727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 -3.3422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0896 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0833 -5.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6667 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4958 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5167 -2.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5125 -2.1000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.3083 -1.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3042 -1.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0958 -2.6833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9250 -1.5125 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0208 -2.2958 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 4.4292 -1.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2542 -1.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6625 -2.2917 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 5.2458 -3.0042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4208 -3.0042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4875 -2.2917 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 6.4833 -1.4667 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4833 -3.1167 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3125 -2.2917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1000 -1.5083 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9208 -0.6875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 11 14 1 1 0 0 0 3 7 1 0 0 0 0 11 15 1 0 0 0 0 3 4 2 0 0 0 0 12 16 1 0 0 0 0 7 8 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 7 9 2 0 0 0 0 18 19 1 0 0 0 0 4 5 1 0 0 0 0 19 20 1 0 0 0 0 5 10 1 0 0 0 0 20 21 1 0 0 0 0 21 16 1 0 0 0 0 2 3 1 0 0 0 0 19 22 1 0 0 0 0 10 11 1 6 0 0 0 22 23 2 0 0 0 0 5 6 2 0 0 0 0 22 24 2 0 0 0 0 11 12 1 0 0 0 0 22 25 1 0 0 0 0 6 1 1 0 0 0 0 15 26 1 0 0 0 0 12 13 2 0 0 0 0 15 27 1 0 0 0 0 M END $$$$ -ISIS- 04110309042D 40 44 0 0 0 0 0 0 0 0999 V2000 0.3777 -3.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3766 -4.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0914 -4.5860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8078 -4.1727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 -3.3422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0896 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0833 -5.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6667 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4958 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5167 -2.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5125 -2.1000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8625 -1.5667 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3083 -1.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3042 -1.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0958 -2.6833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0375 -1.5625 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 1.0333 -0.7375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0333 -2.3875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2125 -1.5583 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0224 -2.2668 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1995 -2.2678 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1983 -0.8433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4357 -1.5479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.8382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4268 -0.1255 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2490 -0.1213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6628 -0.8357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2537 -1.5455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0208 -2.2958 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 4.4292 -1.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4292 -3.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2542 -1.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2542 -3.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6625 -2.2917 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.4875 -2.2917 0.0000 N 0 3 3 0 0 0 0 0 0 0 0 0 6.8958 -1.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7208 -1.5750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1292 -2.2875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7125 -3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8875 -3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4 5 1 0 0 0 0 23 20 1 0 0 0 0 5 10 1 0 0 0 0 20 21 2 0 0 0 0 21 19 1 0 0 0 0 2 3 1 0 0 0 0 24 22 1 0 0 0 0 10 11 1 6 0 0 0 5 6 2 0 0 0 0 23 24 1 0 0 0 0 11 12 1 0 0 0 0 24 25 2 0 0 0 0 6 1 1 0 0 0 0 25 26 1 0 0 0 0 11 13 1 0 0 0 0 26 27 2 0 0 0 0 1 2 2 0 0 0 0 27 28 1 0 0 0 0 28 23 2 0 0 0 0 13 14 2 0 0 0 0 13 29 1 0 0 0 0 3 7 1 0 0 0 0 29 30 1 0 0 0 0 11 15 1 1 0 0 0 29 31 1 0 0 0 0 3 4 2 0 0 0 0 30 32 1 0 0 0 0 12 16 1 0 0 0 0 31 33 1 0 0 0 0 7 8 1 0 0 0 0 32 34 1 0 0 0 0 33 34 1 0 0 0 0 16 17 2 0 0 0 0 34 35 1 0 0 0 0 35 36 1 0 0 0 0 16 18 2 0 0 0 0 36 37 1 0 0 0 0 7 9 2 0 0 0 0 37 38 1 0 0 0 0 16 19 1 0 0 0 0 38 39 1 0 0 0 0 19 22 2 0 0 0 0 39 40 1 0 0 0 0 40 35 1 0 0 0 0 M CHG 1 35 1 M END $$$$ -ISIS- 04110310082D 33 34 0 0 0 0 0 0 0 0999 V2000 0.3777 -3.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3766 -4.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0914 -4.5860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8078 -4.1727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 -3.3422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0896 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0833 -5.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6667 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4958 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5167 -2.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5125 -2.1000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.3083 -1.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3042 -1.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0958 -2.6833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9250 -1.5125 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 4.0208 -2.2958 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 1.1000 -1.5083 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 1.9208 -0.6875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0167 -3.1208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7333 -1.8792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0958 -0.6833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0958 -2.3333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2750 -1.5042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1320 -0.7853 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9562 -0.7808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3732 -1.4937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9599 -2.2127 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1370 -2.2136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2708 -2.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5500 -2.7958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2000 -1.4917 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0250 -1.4875 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2750 -0.0667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7 8 1 0 0 0 0 15 17 1 0 0 0 0 15 18 1 0 0 0 0 7 9 2 0 0 0 0 16 19 1 0 0 0 0 4 5 1 0 0 0 0 16 20 1 0 0 0 0 5 10 1 0 0 0 0 17 21 2 0 0 0 0 2 3 1 0 0 0 0 17 22 2 0 0 0 0 10 11 1 6 0 0 0 17 23 1 0 0 0 0 5 6 2 0 0 0 0 23 24 2 0 0 0 0 11 12 1 0 0 0 0 24 25 1 0 0 0 0 6 1 1 0 0 0 0 25 26 2 0 0 0 0 12 13 2 0 0 0 0 26 27 1 0 0 0 0 1 2 2 0 0 0 0 27 28 2 0 0 0 0 28 23 1 0 0 0 0 11 14 1 1 0 0 0 28 29 1 0 0 0 0 3 7 1 0 0 0 0 27 30 1 0 0 0 0 11 15 1 0 0 0 0 26 31 1 0 0 0 0 3 4 2 0 0 0 0 31 32 1 0 0 0 0 12 16 1 0 0 0 0 24 33 1 0 0 0 0 M END $$$$ -ISIS- 04110310092D 24 25 0 0 0 0 0 0 0 0999 V2000 0.3777 -3.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3766 -4.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0914 -4.5860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8078 -4.1727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 -3.3422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0896 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0833 -5.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6667 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4958 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5167 -2.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5125 -2.1000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.3083 -1.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3042 -1.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0958 -2.6833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9250 -1.5125 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0208 -2.2958 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 1.9208 -0.6875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4292 -1.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2542 -1.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6625 -2.2917 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 5.2458 -3.0042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4208 -3.0042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4875 -2.2917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5083 -2.2250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11 12 1 0 0 0 0 6 1 1 0 0 0 0 12 13 2 0 0 0 0 1 2 2 0 0 0 0 11 14 1 1 0 0 0 3 7 1 0 0 0 0 11 15 1 0 0 0 0 3 4 2 0 0 0 0 12 16 1 0 0 0 0 7 8 1 0 0 0 0 15 17 1 0 0 0 0 16 18 1 0 0 0 0 7 9 2 0 0 0 0 18 19 1 0 0 0 0 4 5 1 0 0 0 0 19 20 1 0 0 0 0 5 10 1 0 0 0 0 20 21 1 0 0 0 0 2 3 1 0 0 0 0 21 22 1 0 0 0 0 22 16 1 0 0 0 0 10 11 1 6 0 0 0 20 23 1 0 0 0 0 5 6 2 0 0 0 0 15 24 1 0 0 0 0 M END $$$$ -ISIS- 04110309332D 31 33 0 0 0 0 0 0 0 0999 V2000 0.3777 -3.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3766 -4.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0914 -4.5860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8078 -4.1727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 -3.3422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0896 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0833 -5.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6667 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4958 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5167 -2.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5125 -2.1000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8625 -1.5667 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3083 -1.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3042 -1.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0958 -2.6833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0375 -1.5625 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 1.0333 -0.7375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0333 -2.3875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2125 -1.5625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1981 -0.8457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0188 -2.2772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1959 -2.2740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4357 -1.5604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0221 -0.8471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.1344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2573 -0.1338 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6690 -0.8518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2557 -1.5616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0208 -2.2958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0167 -3.1208 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7333 -1.8792 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 3 4 2 0 0 0 0 12 16 1 0 0 0 0 7 8 1 0 0 0 0 16 17 2 0 0 0 0 16 18 2 0 0 0 0 7 9 2 0 0 0 0 16 19 1 0 0 0 0 4 5 1 0 0 0 0 19 20 2 0 0 0 0 20 24 1 0 0 0 0 5 10 1 0 0 0 0 23 21 1 0 0 0 0 2 3 1 0 0 0 0 21 22 2 0 0 0 0 22 19 1 0 0 0 0 10 11 1 6 0 0 0 5 6 2 0 0 0 0 23 24 1 0 0 0 0 11 12 1 0 0 0 0 24 25 2 0 0 0 0 6 1 1 0 0 0 0 25 26 1 0 0 0 0 11 13 1 0 0 0 0 26 27 2 0 0 0 0 1 2 2 0 0 0 0 27 28 1 0 0 0 0 28 23 2 0 0 0 0 13 14 2 0 0 0 0 13 29 1 0 0 0 0 3 7 1 0 0 0 0 29 30 2 0 0 0 0 11 15 1 1 0 0 0 29 31 1 0 0 0 0 M CHG 1 31 -1 M END $$$$ -ISIS- 04110309342D 41 45 0 0 0 0 0 0 0 0999 V2000 0.3777 -3.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3766 -4.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0914 -4.5860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8078 -4.1727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 -3.3422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0896 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0833 -5.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6667 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4958 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5167 -2.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5125 -2.1000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8625 -1.5667 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3083 -1.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3042 -1.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0958 -2.6833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0375 -1.5625 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 1.0333 -0.7375 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0333 -2.3875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2125 -1.5625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1981 -0.8457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0188 -2.2772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1959 -2.2740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4357 -1.5604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0221 -0.8471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.1344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2573 -0.1338 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6690 -0.8518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2557 -1.5616 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0208 -2.2958 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 5.6625 -2.2917 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2458 -3.0042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4208 -3.0042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6542 -3.7167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4500 -3.9292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9375 -4.1250 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 4.4291 -1.5806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2542 -1.5792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6636 -0.8651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2492 -0.1520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4211 -0.1574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0153 -0.8720 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20 24 1 0 0 0 0 5 10 1 0 0 0 0 23 21 1 0 0 0 0 2 3 1 0 0 0 0 21 22 2 0 0 0 0 22 19 1 0 0 0 0 10 11 1 6 0 0 0 5 6 2 0 0 0 0 23 24 1 0 0 0 0 11 12 1 0 0 0 0 24 25 2 0 0 0 0 6 1 1 0 0 0 0 25 26 1 0 0 0 0 11 13 1 0 0 0 0 26 27 2 0 0 0 0 1 2 2 0 0 0 0 27 28 1 0 0 0 0 28 23 2 0 0 0 0 13 14 2 0 0 0 0 13 29 1 0 0 0 0 29 36 1 0 0 0 0 3 7 1 0 0 0 0 37 30 1 0 0 0 0 11 15 1 1 0 0 0 30 31 2 0 0 0 0 3 4 2 0 0 0 0 31 32 1 0 0 0 0 32 29 1 0 0 0 0 12 16 1 0 0 0 0 31 33 1 0 0 0 0 7 8 1 0 0 0 0 33 34 2 0 0 0 0 16 17 2 0 0 0 0 33 35 1 0 0 0 0 16 18 2 0 0 0 0 36 37 2 0 0 0 0 7 9 2 0 0 0 0 37 38 1 0 0 0 0 16 19 1 0 0 0 0 38 39 2 0 0 0 0 4 5 1 0 0 0 0 39 40 1 0 0 0 0 19 20 2 0 0 0 0 40 41 2 0 0 0 0 41 36 1 0 0 0 0 M CHG 1 35 -1 M END $$$$ -ISIS- 04110310102D 31 32 0 0 0 0 0 0 0 0999 V2000 0.3777 -3.3458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3766 -4.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0914 -4.5860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8078 -4.1727 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 -3.3422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0896 -2.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0833 -5.4083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6667 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4958 -5.9917 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5167 -2.9250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5125 -2.1000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.3083 -1.8833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3042 -1.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0958 -2.6833 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9250 -1.5125 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 4.0208 -2.2958 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 4.0167 -3.1208 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6042 -1.7083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9208 -0.6875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1000 -1.5083 0.0000 S 0 0 3 0 0 0 0 0 0 0 0 0 1.0958 -0.6833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0958 -2.3333 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2750 -1.5083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1356 -0.7915 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9599 -0.7912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3732 -1.5062 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9563 -2.2230 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1334 -2.2199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2708 -0.0708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2708 -2.9292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2000 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3 4 2 0 0 0 0 12 16 1 0 0 0 0 7 8 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 7 9 2 0 0 0 0 15 19 1 0 0 0 0 4 5 1 0 0 0 0 15 20 1 0 0 0 0 5 10 1 0 0 0 0 20 21 2 0 0 0 0 2 3 1 0 0 0 0 20 22 2 0 0 0 0 10 11 1 6 0 0 0 20 23 1 0 0 0 0 5 6 2 0 0 0 0 23 24 2 0 0 0 0 11 12 1 0 0 0 0 24 25 1 0 0 0 0 6 1 1 0 0 0 0 25 26 2 0 0 0 0 12 13 2 0 0 0 0 26 27 1 0 0 0 0 1 2 2 0 0 0 0 27 28 2 0 0 0 0 28 23 1 0 0 0 0 11 14 1 1 0 0 0 24 29 1 0 0 0 0 3 7 1 0 0 0 0 28 30 1 0 0 0 0 11 15 1 0 0 0 0 26 31 1 0 0 0 0 M END $$$$