NCI:291055 BBtclserve11129918452D 0 0.00000 0.00000164214 53811-27-1 30 33 0 0 0 0 0 0 0 0 2 V2000 3.6750 -0.7852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8090 -0.2852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6750 -1.7852 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.5411 -0.2852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8090 0.7148 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6750 -1.7852 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6750 -1.7852 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6750 -2.7852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4546 -0.6920 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6456 0.7093 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6180 1.3026 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.3026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8090 -3.2852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5411 -3.2852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1237 0.0512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6237 0.9172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3090 2.2536 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3090 2.2536 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8090 -4.2852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5410 -4.2852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1183 -0.0533 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 3.8968 3.0626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6750 -4.7852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7060 0.7557 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5250 -0.9669 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 4.8913 2.9581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4901 3.9762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4791 3.7671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0779 4.7852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0724 4.6807 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 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 2 0 0 0 0 3 8 1 0 0 0 0 4 9 1 0 0 0 0 4 10 2 0 0 0 0 5 11 1 0 0 0 0 5 12 2 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 10 16 1 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 1 0 0 0 0 17 22 1 0 0 0 0 19 23 2 0 0 0 0 21 24 2 0 0 0 0 21 25 1 0 0 0 0 22 26 2 0 0 0 0 22 27 1 0 0 0 0 26 28 1 0 0 0 0 27 29 2 0 0 0 0 28 30 2 0 0 0 0 15 16 2 0 0 0 0 17 18 2 0 0 0 0 20 23 1 0 0 0 0 29 30 1 0 0 0 0 M CHG 2 21 1 25 -1 M END