ABtkserver05010412312D 0 0.00000 0.00000??? 22 22 0 0 0 0 0 0 0 0999 V2000 93.0000 183.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 93.0000 138.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 131.9711 205.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 170.9423 183.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 170.9423 138.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 131.9712 115.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 209.9134 205.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 248.8846 183.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 287.8557 205.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 326.8268 183.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 68.8379 196.9500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 68.8379 124.0500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 131.9711 233.4000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 131.9712 87.6000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 227.8472 226.8726 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 191.9797 226.8727 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 230.9508 161.6274 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 266.8183 161.6274 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 287.8557 233.4000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 312.8768 158.8379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 350.9890 169.0500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 340.7769 207.1621 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 2 6 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 1 11 1 0 0 0 0 2 12 1 0 0 0 0 3 13 1 0 0 0 0 6 14 1 0 0 0 0 7 15 1 0 0 0 0 7 16 1 0 0 0 0 8 17 1 0 0 0 0 8 18 1 0 0 0 0 9 19 1 0 0 0 0 10 20 1 0 0 0 0 10 21 1 0 0 0 0 10 22 1 0 0 0 0 M END $$$$ C8H12N2 ABtkserver05010412322D 0 0.00000 0.00000??? 22 22 0 0 0 0 0 0 0 0999 V2000 93.0000 183.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 93.0000 138.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 131.9711 205.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 170.9423 183.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 170.9423 138.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 131.9712 115.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 209.9134 205.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 248.8846 183.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 287.8557 205.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 326.8268 183.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 68.8379 196.9500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 68.8379 124.0500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 131.9711 233.4000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 131.9712 87.6000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 227.8472 226.8726 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 191.9797 226.8727 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 230.9508 161.6274 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 266.8183 161.6274 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 287.8557 233.4000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 312.8768 158.8379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 350.9890 169.0500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 340.7769 207.1621 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 2 6 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 1 11 1 0 0 0 0 2 12 1 0 0 0 0 3 13 1 0 0 0 0 6 14 1 0 0 0 0 7 15 1 0 0 0 0 7 16 1 0 0 0 0 8 17 1 0 0 0 0 8 18 1 0 0 0 0 9 19 1 0 0 0 0 10 20 1 0 0 0 0 10 21 1 0 0 0 0 10 22 1 0 0 0 0 M END $$$$ C8H12N2 ABtkserver05010412332D 0 0.00000 0.00000??? 16 16 0 0 0 0 0 0 0 0999 V2000 110.0000 167.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 132.5000 128.0289 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 140.1109 200.4415 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 181.2204 182.1383 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 176.5166 137.3848 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 220.1916 204.6383 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 253.6331 174.5274 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 292.6042 197.0274 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 82.2528 169.9163 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 121.1520 102.5409 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 240.9253 223.3070 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 203.7924 227.2098 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 232.8994 155.8587 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 270.0323 151.9558 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 316.7664 183.0774 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 292.6043 224.9274 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 2 5 1 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 1 9 1 0 0 0 0 2 10 1 0 0 0 0 6 11 1 0 0 0 0 6 12 1 0 0 0 0 7 13 1 0 0 0 0 7 14 1 0 0 0 0 8 15 1 0 0 0 0 8 16 1 0 0 0 0 M END $$$$ C8H12N2 ABtkserver05010412342D 0 0.00000 0.00000??? 26 27 0 0 0 0 0 0 0 0999 V2000 110.0000 167.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 132.5000 128.0289 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 140.1109 200.4415 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 181.2204 182.1383 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 176.5166 137.3848 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 220.1916 204.6383 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 253.6331 174.5274 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 292.6042 197.0274 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 82.2528 169.9163 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 121.1520 102.5409 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 240.9253 223.3070 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 203.7924 227.2098 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 232.8994 155.8587 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 270.0323 151.9558 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 316.7664 183.0774 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 292.6043 224.9274 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 63.9496 211.0258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.1961 215.7295 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2542 179.3237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0490 138.2142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 55.8025 133.5105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 80.3487 233.5974 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8481 241.2174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -35.0013 182.2400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3502 115.6426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 67.1505 108.0226 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 2 5 1 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 1 9 1 0 0 0 0 2 10 1 0 0 0 0 6 11 1 0 0 0 0 6 12 1 0 0 0 0 7 13 1 0 0 0 0 7 14 1 0 0 0 0 8 15 1 0 0 0 0 8 16 1 0 0 0 0 9 17 2 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 9 21 1 0 0 0 0 17 22 1 0 0 0 0 18 23 1 0 0 0 0 19 24 1 0 0 0 0 20 25 1 0 0 0 0 21 26 1 0 0 0 0 M END $$$$ C8H12N2 ABtkserver05010412352D 0 0.00000 0.00000??? 23 24 0 0 0 0 0 0 0 0999 V2000 -3.0000 174.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0000 129.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 35.9711 106.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 74.9423 129.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 74.9423 174.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 35.9712 196.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 113.9134 106.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 113.9134 196.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 152.8846 174.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 196.3513 185.6469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 198.7064 230.5852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 242.1731 242.2321 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -27.1621 187.9500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -27.1621 115.0500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 35.9711 78.6000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 35.9712 224.4000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 113.9134 224.4000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 200.7158 158.0903 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 224.2130 187.1070 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 194.3419 258.1418 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 170.8446 229.1251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 261.9013 222.5038 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 249.3941 269.1814 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 2 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 1 6 2 0 0 0 0 4 7 2 0 0 0 0 5 8 1 0 0 0 0 8 9 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 1 13 1 0 0 0 0 2 14 1 0 0 0 0 3 15 1 0 0 0 0 6 16 1 0 0 0 0 8 17 1 0 0 0 0 10 18 1 0 0 0 0 10 19 1 0 0 0 0 11 20 1 0 0 0 0 11 21 1 0 0 0 0 12 22 1 0 0 0 0 12 23 1 0 0 0 0 M END $$$$ C8H12N2 ABtkserver05010412362D 0 0.00000 0.00000??? 45 46 0 0 0 0 0 0 0 0999 V2000 -3.0000 174.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0000 129.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 35.9711 106.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 74.9423 129.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 74.9423 174.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 35.9712 196.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 113.9134 106.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -27.1621 187.9500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -27.1621 115.0500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 35.9711 78.6000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 35.9712 224.4000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 117.7398 187.9058 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 144.1902 151.5001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 189.1829 152.3117 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4346 250.8503 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -43.2321 236.9445 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -76.6736 267.0553 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -119.4711 253.1495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -152.9126 283.2603 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -52.5881 192.9278 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -95.3856 179.0220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -104.7416 135.0053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 74.9423 101.1000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 120.2054 79.3187 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 35.9711 50.7000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 63.2615 218.5993 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 47.3191 249.8879 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 141.9019 201.8558 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 106.3919 213.3937 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.2992 269.5191 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.3846 275.0125 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -54.6882 284.2323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -89.7719 291.6895 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -141.4566 235.9725 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -106.3728 228.5153 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -134.2439 303.9941 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -173.6464 301.9291 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -171.5814 262.5266 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -48.7051 165.2994 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -24.7051 191.9542 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -99.2686 206.6505 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -123.2686 179.9957 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -132.0319 140.8060 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -110.5423 107.7150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -77.4512 129.2047 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 2 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 1 6 2 0 0 0 0 4 7 1 0 0 0 0 1 8 1 0 0 0 0 2 9 1 0 0 0 0 3 10 1 0 0 0 0 6 11 1 0 0 0 0 5 12 1 0 0 0 0 12 13 1 0 0 0 0 7 13 1 0 0 0 0 13 14 2 0 0 0 0 11 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 16 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 4 23 1 0 0 0 0 7 24 1 0 0 0 0 10 25 1 0 0 0 0 11 26 1 0 0 0 0 11 27 1 0 0 0 0 12 28 1 0 0 0 0 12 29 1 0 0 0 0 15 30 1 0 0 0 0 15 31 1 0 0 0 0 17 32 1 0 0 0 0 17 33 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 M END $$$$ C8H12N2 ABtkserver05010412372D 0 0.00000 0.00000??? 44 45 0 0 0 0 0 0 0 0999 V2000 -3.0000 174.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0000 129.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 35.9711 106.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 74.9423 129.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 74.9423 174.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 35.9712 196.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 113.9134 106.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -27.1621 187.9500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -27.1621 115.0500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 35.9712 224.4000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 117.7398 187.9058 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 144.1902 151.5001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 189.1829 152.3117 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4346 250.8503 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -43.2321 236.9445 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -76.6736 267.0553 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -119.4711 253.1495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -152.9126 283.2603 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -52.5881 192.9278 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -95.3856 179.0220 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -104.7416 135.0053 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 74.9423 101.1000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 120.2054 79.3187 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 63.2615 218.5993 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 47.3191 249.8879 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 141.9019 201.8558 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 106.3919 213.3937 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 20.2992 269.5191 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.3846 275.0125 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -54.6882 284.2323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -89.7719 291.6895 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -141.4566 235.9725 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -106.3728 228.5153 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -134.2439 303.9941 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -173.6464 301.9291 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -171.5814 262.5266 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -48.7051 165.2994 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -24.7051 191.9542 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -99.2686 206.6505 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -123.2686 179.9957 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -132.0319 140.8060 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -110.5423 107.7150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -77.4512 129.2047 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 35.9711 78.6000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 2 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 1 6 2 0 0 0 0 4 7 1 0 0 0 0 1 8 1 0 0 0 0 2 9 1 0 0 0 0 6 10 1 0 0 0 0 5 11 1 0 0 0 0 11 12 1 0 0 0 0 7 12 1 0 0 0 0 12 13 2 0 0 0 0 10 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 15 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 4 22 1 0 0 0 0 7 23 1 0 0 0 0 10 24 1 0 0 0 0 10 25 1 0 0 0 0 11 26 1 0 0 0 0 11 27 1 0 0 0 0 14 28 1 0 0 0 0 14 29 1 0 0 0 0 16 30 1 0 0 0 0 16 31 1 0 0 0 0 17 32 1 0 0 0 0 17 33 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 3 44 1 0 0 0 0 M END $$$$ C8H12N2 ABtkserver05010412382D 0 0.00000 0.00000??? 30 32 0 0 0 0 0 0 0 0999 V2000 -156.0000 210.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -156.0000 165.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -117.0289 232.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -78.0577 210.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -78.0577 165.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -117.0288 142.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -39.0866 232.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8027 216.0597 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0667 173.0589 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2827 135.8781 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -54.1569 132.5152 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 59.9385 163.0455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 73.2025 120.0447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 42.5947 87.0574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2770 97.0709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -72.2130 91.2965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -45.5446 55.0501 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -116.9374 86.3242 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -180.1621 223.9500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -180.1621 151.0500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -117.0289 260.4000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -117.0288 114.6000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -41.1715 260.3220 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 23.2549 235.0365 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 78.9153 183.4976 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 100.4030 113.8364 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 50.8184 60.3969 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -21.2110 77.5505 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -133.4718 108.7969 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -128.1322 60.7686 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 2 6 1 0 0 0 0 4 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 5 11 1 0 0 0 0 9 12 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 10 15 1 0 0 0 0 11 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 1 19 1 0 0 0 0 2 20 1 0 0 0 0 3 21 1 0 0 0 0 6 22 1 0 0 0 0 7 23 1 0 0 0 0 8 24 1 0 0 0 0 12 25 1 0 0 0 0 13 26 1 0 0 0 0 14 27 1 0 0 0 0 15 28 1 0 0 0 0 18 29 1 0 0 0 0 18 30 1 0 0 0 0 M END $$$$ C8H12N2 ABtkserver05010412382D 0 0.00000 0.00000??? 31 34 0 0 0 0 0 0 0 0999 V2000 -156.0000 210.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -156.0000 165.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -117.0289 232.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -78.0577 210.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -78.0577 165.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -117.0288 142.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8027 216.0597 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0667 173.0589 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2827 135.8781 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -54.1569 132.5152 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 59.9385 163.0455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 73.2025 120.0447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 42.5947 87.0574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2770 97.0709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -72.2130 91.2965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -45.5446 55.0501 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -116.9374 86.3242 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -180.1621 223.9500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -180.1621 151.0500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -117.0289 260.4000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -117.0288 114.6000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 78.9153 183.4976 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 100.4030 113.8364 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 50.8184 60.3969 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -21.2110 77.5505 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -133.4718 108.7969 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -128.1322 60.7686 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -39.0866 232.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0000 247.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 29.5521 223.9894 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -51.6802 257.3960 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 2 6 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 5 10 1 0 0 0 0 8 11 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 9 14 1 0 0 0 0 10 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 1 18 1 0 0 0 0 2 19 1 0 0 0 0 3 20 1 0 0 0 0 6 21 1 0 0 0 0 11 22 1 0 0 0 0 12 23 1 0 0 0 0 13 24 1 0 0 0 0 14 25 1 0 0 0 0 17 26 1 0 0 0 0 17 27 1 0 0 0 0 4 28 1 0 0 0 0 7 28 1 0 0 0 0 28 29 1 0 0 0 0 7 29 1 0 0 0 0 7 30 1 0 0 0 0 28 31 1 0 0 0 0 M END $$$$ C8H12N2 ABtkserver05010412462D 0 0.00000 0.00000??? 41 44 0 0 0 0 0 0 0 0999 V2000 -194.0000 168.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -194.0000 123.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -155.0289 100.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -116.0577 123.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -116.0577 168.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -155.0288 190.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -77.0866 100.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -35.1973 116.9403 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -21.9333 159.9411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -47.2827 197.1219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -155.0289 55.5000 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -80.4495 55.6258 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2100 86.3325 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -80.8753 196.0570 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -96.4090 238.2909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -65.0974 270.6109 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -26.0000 240.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9881 249.4895 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 36.1665 290.6544 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 80.9340 286.0864 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 90.4235 242.0983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 51.5208 219.4802 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 131.5884 223.9199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 161.5977 257.4526 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 141.0779 179.9318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -218.1621 181.9500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -218.1621 109.0500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -155.0288 218.4000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2288 145.9911 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9565 180.3932 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -21.1868 65.8804 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.2421 67.3557 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7669 106.7846 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -123.7044 244.0675 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 109.9594 206.2962 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 182.3880 238.8468 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 180.2035 278.2428 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 140.8075 276.0584 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 113.8053 174.0483 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 146.9614 152.6592 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 168.3505 185.8153 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 1 6 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 3 11 1 0 0 0 0 7 12 2 0 0 0 0 8 13 1 0 0 0 0 5 14 1 0 0 0 0 10 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 10 17 2 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 18 22 1 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 1 26 1 0 0 0 0 2 27 1 0 0 0 0 6 28 1 0 0 0 0 9 29 1 0 0 0 0 9 30 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 13 33 1 0 0 0 0 15 34 1 0 0 0 0 23 35 1 0 0 0 0 24 36 1 0 0 0 0 24 37 1 0 0 0 0 24 38 1 0 0 0 0 25 39 1 0 0 0 0 25 40 1 0 0 0 0 25 41 1 0 0 0 0 M END $$$$ C8H12N2 ABtkserver05010412472D 0 0.00000 0.00000??? 42 45 0 0 0 0 0 0 0 0999 V2000 -194.0000 168.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -194.0000 123.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -155.0289 100.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -116.0577 123.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -116.0577 168.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -155.0288 190.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -77.0866 100.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -35.1973 116.9403 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -21.9333 159.9411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -47.2827 197.1219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -155.0289 55.5000 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -80.4495 55.6258 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2100 86.3325 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -80.8753 196.0570 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -96.4090 238.2909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -65.0974 270.6109 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -26.0000 240.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9881 249.4895 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 36.1665 290.6544 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 80.9340 286.0864 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 90.4235 242.0983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 51.5208 219.4802 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 161.5977 257.4526 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 141.0779 179.9318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -218.1621 181.9500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -218.1621 109.0500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -155.0288 218.4000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2288 145.9911 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9565 180.3932 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -21.1868 65.8804 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.2421 67.3557 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7669 106.7846 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -123.7044 244.0675 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 182.3880 238.8468 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 180.2035 278.2428 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 140.8075 276.0584 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 113.8053 174.0483 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 146.9614 152.6592 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 168.3505 185.8153 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 131.5884 223.9199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 96.7029 195.4945 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 75.0739 177.8708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 1 6 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 3 11 1 0 0 0 0 7 12 2 0 0 0 0 8 13 1 0 0 0 0 5 14 1 0 0 0 0 10 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 10 17 2 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 18 22 1 0 0 0 0 1 25 1 0 0 0 0 2 26 1 0 0 0 0 6 27 1 0 0 0 0 9 28 1 0 0 0 0 9 29 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 15 33 1 0 0 0 0 23 34 1 0 0 0 0 23 35 1 0 0 0 0 23 36 1 0 0 0 0 24 37 1 0 0 0 0 24 38 1 0 0 0 0 24 39 1 0 0 0 0 21 40 1 0 0 0 0 23 40 1 0 0 0 0 24 40 1 0 0 0 0 40 41 1 0 0 0 0 41 42 1 0 0 0 0 M END $$$$ C8H12N2 ABtkserver05010412472D 0 0.00000 0.00000??? 43 46 0 0 0 0 0 0 0 0999 V2000 -194.0000 168.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -194.0000 123.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -155.0289 100.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -116.0577 123.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -116.0577 168.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -155.0288 190.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -77.0866 100.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -35.1973 116.9403 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -21.9333 159.9411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -47.2827 197.1219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -155.0289 55.5000 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -80.4495 55.6258 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2100 86.3325 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -80.8753 196.0570 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -96.4090 238.2909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -65.0974 270.6109 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -26.0000 240.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.9881 249.4895 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 36.1665 290.6544 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 80.9340 286.0864 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 90.4235 242.0983 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 51.5208 219.4802 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 161.5977 257.4526 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 141.0779 179.9318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -218.1621 181.9500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -218.1621 109.0500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -155.0288 218.4000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2288 145.9911 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9565 180.3932 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -21.1868 65.8804 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.2421 67.3557 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7669 106.7846 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -123.7044 244.0675 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 182.3880 238.8468 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 140.8075 276.0584 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 113.8053 174.0483 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 146.9614 152.6592 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 168.3505 185.8153 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 131.5884 223.9199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 96.7029 195.4945 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 75.0739 177.8708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 191.6071 290.9853 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 210.2128 311.7755 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 1 6 1 0 0 0 0 4 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 3 11 1 0 0 0 0 7 12 2 0 0 0 0 8 13 1 0 0 0 0 5 14 1 0 0 0 0 10 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 10 17 2 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 18 22 1 0 0 0 0 1 25 1 0 0 0 0 2 26 1 0 0 0 0 6 27 1 0 0 0 0 9 28 1 0 0 0 0 9 29 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 13 32 1 0 0 0 0 15 33 1 0 0 0 0 23 34 1 0 0 0 0 23 35 1 0 0 0 0 24 36 1 0 0 0 0 24 37 1 0 0 0 0 24 38 1 0 0 0 0 21 39 1 0 0 0 0 23 39 1 0 0 0 0 24 39 1 0 0 0 0 39 40 1 0 0 0 0 40 41 1 0 0 0 0 23 42 1 0 0 0 0 42 43 1 0 0 0 0 M END $$$$ C8H12N2 ABtkserver05010412402D 0 0.00000 0.00000??? 44 46 0 0 0 0 0 0 0 0999 V2000 -156.0000 210.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -156.0000 165.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -117.0289 232.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -78.0577 210.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -78.0577 165.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -117.0288 142.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8027 216.0597 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0667 173.0589 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2827 135.8781 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 59.9385 163.0455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 73.2025 120.0447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 42.5947 87.0574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2770 97.0709 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -180.1621 223.9500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -180.1621 151.0500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -117.0289 260.4000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -117.0288 114.6000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 78.9153 183.4976 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 100.4030 113.8364 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 50.8184 60.3969 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -21.2110 77.5505 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -39.0866 232.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -42.8753 136.9430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -58.4090 94.7091 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -102.7515 87.0447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -118.2852 44.8108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -162.6277 37.1464 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -191.4365 71.7159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -158.0000 5.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 30.6247 218.1447 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9610 243.6481 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -23.3699 255.5521 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -58.0634 252.9522 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -40.5475 73.2759 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -102.6572 114.9446 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -130.2111 91.9823 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -118.3795 16.9109 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -90.8256 39.8732 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -170.0034 89.5774 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -209.2980 93.1490 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -212.8696 53.8545 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -185.6153 1.0246 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -154.0246 -22.6153 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -130.3847 8.9754 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 2 6 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 9 13 1 0 0 0 0 1 14 1 0 0 0 0 2 15 1 0 0 0 0 3 16 1 0 0 0 0 6 17 1 0 0 0 0 10 18 1 0 0 0 0 11 19 1 0 0 0 0 12 20 1 0 0 0 0 13 21 1 0 0 0 0 4 22 1 0 0 0 0 7 22 1 0 0 0 0 5 23 1 0 0 0 0 9 23 1 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 22 32 1 0 0 0 0 22 33 1 0 0 0 0 24 34 1 0 0 0 0 25 35 1 0 0 0 0 25 36 1 0 0 0 0 26 37 1 0 0 0 0 26 38 1 0 0 0 0 28 39 1 0 0 0 0 28 40 1 0 0 0 0 28 41 1 0 0 0 0 29 42 1 0 0 0 0 29 43 1 0 0 0 0 29 44 1 0 0 0 0 M END $$$$