NCI:43451 BBtclserve11129917002D 0 0.00000 0.00000 37785 50652-91-0 19 19 0 0 0 0 0 0 0 0 2 V2000 4.5981 0.4510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.9510 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 0.9510 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.5490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.4510 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9641 1.8170 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9641 0.0849 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -1.0490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.0490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 2.4510 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 2.6830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -2.0490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.0490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 2.9509 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9641 3.5490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.5490 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 4.5981 -2.5490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.5490 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.0490 0.0000 O 0 5 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 2 6 1 0 0 0 0 2 7 2 0 0 0 0 4 8 2 0 0 0 0 4 9 1 0 0 0 0 5 10 1 0 0 0 0 6 11 1 0 0 0 0 8 12 1 0 0 0 0 9 13 2 0 0 0 0 10 14 1 0 0 0 0 11 15 1 0 0 0 0 12 16 1 0 0 0 0 12 17 2 0 0 0 0 16 18 2 0 0 0 0 16 19 1 0 0 0 0 13 17 1 0 0 0 0 M CHG 2 16 1 19 -1 M END