NCI:173207 BBtclserve11129918062D 0 0.00000 0.00000127959 999-99-9 31 32 0 0 0 0 0 0 0 0 2 V2000 3.7979 0.4466 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8469 0.1376 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 4.5411 -0.2226 0.0000 Cu 0 0 0 0 0 0 0 0 0 0 0 0 2.1037 0.8067 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6390 -0.8406 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 4.9141 -1.1504 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6751 -0.7226 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9478 0.6910 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5356 -0.3271 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4071 -1.7226 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9041 -1.2913 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 3.6751 -1.7226 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3600 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1234 0.4819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5411 -2.2226 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2771 -2.2191 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5211 -0.5044 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 2.8090 -2.2226 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7668 2.4135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1179 0.3774 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5411 -3.2226 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8090 -3.2226 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1790 3.2226 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.8103 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6180 -3.8103 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1790 3.2226 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4880 4.1736 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3090 -4.7614 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3090 -4.7614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8700 4.1736 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6790 4.7614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 2 4 2 0 0 0 0 2 5 1 0 0 0 0 3 6 1 0 0 0 0 3 9 1 0 0 0 0 3 10 1 0 0 0 0 6 11 1 0 0 0 0 7 12 1 0 0 0 0 8 13 1 0 0 0 0 9 14 1 0 0 0 0 10 15 1 0 0 0 0 11 16 2 0 0 0 0 11 17 1 0 0 0 0 12 18 1 0 0 0 0 13 19 1 0 0 0 0 14 20 2 0 0 0 0 15 21 2 0 0 0 0 18 22 1 0 0 0 0 19 23 1 0 0 0 0 22 24 2 0 0 0 0 22 25 1 0 0 0 0 23 26 2 0 0 0 0 23 27 1 0 0 0 0 24 28 1 0 0 0 0 25 29 2 0 0 0 0 26 30 1 0 0 0 0 27 31 2 0 0 0 0 13 14 1 0 0 0 0 12 15 1 0 0 0 0 28 29 1 0 0 0 0 30 31 1 0 0 0 0 M CHG 4 2 1 5 -1 11 1 17 -1 M END