NCI:17113 BBtclserve11129916472D 0 0.00000 0.00000 16257 3862-05-3 32 34 0 0 0 0 0 0 0 0 2 V2000 5.7091 -0.2138 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 4.7700 -0.5574 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6482 0.1299 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3654 0.7253 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0528 -1.1529 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.5425 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8201 1.1150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3803 0.8973 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -2.0425 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.0425 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7592 1.4586 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0530 1.7564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0367 1.8364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7389 0.1301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.5425 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 3.7320 -3.0425 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -3.0425 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5264 0.8172 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 7.9312 2.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2249 2.7416 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6781 2.6035 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 3.0516 2.0083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7538 0.3020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.0425 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.5425 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 4.5981 -3.5425 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4655 1.1609 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3545 -0.1679 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 7.1640 3.0852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6632 2.4316 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3345 3.5425 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 2.4101 1.2411 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 1 5 2 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 6 9 2 0 0 0 0 6 10 1 0 0 0 0 7 11 2 0 0 0 0 7 12 1 0 0 0 0 8 13 2 0 0 0 0 8 14 1 0 0 0 0 9 15 1 0 0 0 0 9 16 1 0 0 0 0 10 17 2 0 0 0 0 11 18 1 0 0 0 0 11 19 1 0 0 0 0 12 20 2 0 0 0 0 13 21 1 0 0 0 0 13 22 1 0 0 0 0 14 23 2 0 0 0 0 15 24 2 0 0 0 0 15 25 1 0 0 0 0 16 26 2 0 0 0 0 18 27 2 0 0 0 0 18 28 1 0 0 0 0 19 29 2 0 0 0 0 21 30 2 0 0 0 0 21 31 1 0 0 0 0 22 32 2 0 0 0 0 17 26 1 0 0 0 0 20 29 1 0 0 0 0 23 32 1 0 0 0 0 M CHG 6 15 1 18 1 21 1 25 -1 28 -1 31 -1 M END