NCI:46627 BBtclserve11129917022D 0 0.00000 0.00000 40390 999-99-9 31 32 0 0 0 0 0 0 0 0 2 V2000 4.5981 1.1772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 1.6772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.1772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.6772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 2.6772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -0.3228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.3228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8029 2.6181 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1096 0.9134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.1772 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 3.7320 -1.3228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.3228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1574 3.3819 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 6.7870 2.7952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0938 1.0905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.3228 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.1772 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 4.5981 -1.8228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4961 4.3228 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1732 3.2048 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 7.4325 2.0314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.8228 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.4167 2.2085 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.3228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -3.3228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0622 1.4447 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7554 3.1493 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -4.3228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -4.3228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0463 1.6217 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7396 3.3264 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 1 4 1 0 0 0 0 2 5 1 0 0 0 0 3 6 2 0 0 0 0 3 7 1 0 0 0 0 4 8 2 0 0 0 0 4 9 1 0 0 0 0 6 10 1 0 0 0 0 6 11 1 0 0 0 0 7 12 2 0 0 0 0 8 13 1 0 0 0 0 8 14 1 0 0 0 0 9 15 2 0 0 0 0 10 16 2 0 0 0 0 10 17 1 0 0 0 0 11 18 2 0 0 0 0 13 19 2 0 0 0 0 13 20 1 0 0 0 0 14 21 2 0 0 0 0 18 22 1 0 0 0 0 21 23 1 0 0 0 0 22 24 1 0 0 0 0 22 25 1 0 0 0 0 23 26 1 0 0 0 0 23 27 1 0 0 0 0 24 28 1 0 0 0 0 25 29 1 0 0 0 0 26 30 1 0 0 0 0 27 31 1 0 0 0 0 12 18 1 0 0 0 0 15 21 1 0 0 0 0 M CHG 4 10 1 13 1 17 -1 20 -1 M END