NCI:106494 BBtclserve11129917282D 0 0.00000 0.00000 82153 999-99-9 35 36 0 0 0 0 0 0 0 0 2 V2000 4.5981 -0.3691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.1309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 0.1309 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.3691 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2313 -0.5106 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6360 1.1160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.3691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.8691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.8691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1704 -0.1669 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8689 1.7574 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5751 1.4596 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.1309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.3691 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.8691 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.8691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9375 -0.8084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3423 0.8182 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0408 2.7426 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9298 1.4138 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.3691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -3.3691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7656 -1.7935 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 8.8766 -0.4647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2814 1.1619 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2736 3.3840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9799 3.0862 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -4.3691 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5328 -2.4349 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8265 -2.1371 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 9.0486 0.5204 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4456 4.3691 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9876 0.8641 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 10.1596 1.8492 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7548 0.2226 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 3 7 1 0 0 0 0 4 8 1 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 6 12 1 0 0 0 0 7 13 1 0 0 0 0 8 14 2 0 0 0 0 8 15 1 0 0 0 0 9 16 2 0 0 0 0 10 17 2 0 0 0 0 10 18 1 0 0 0 0 11 19 1 0 0 0 0 11 20 1 0 0 0 0 15 21 1 0 0 0 0 16 22 1 0 0 0 0 17 23 1 0 0 0 0 17 24 1 0 0 0 0 18 25 2 0 0 0 0 19 26 1 0 0 0 0 19 27 1 0 0 0 0 21 28 2 0 0 0 0 23 29 2 0 0 0 0 23 30 1 0 0 0 0 24 31 2 0 0 0 0 26 32 1 0 0 0 0 31 33 1 0 0 0 0 33 34 2 0 0 0 0 33 35 1 0 0 0 0 16 21 1 0 0 0 0 25 31 1 0 0 0 0 M CHG 4 23 1 30 -1 33 1 35 -1 M END