NCI:152640 BBtclserve11129917532D 0 0.00000 0.00000113643 51471-49-9 39 41 0 0 0 0 0 0 0 0 2 V2000 12.3923 2.5000 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 13.2583 3.0000 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 11.5263 3.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2583 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1244 1.5000 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 13.2583 0.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 1.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 0.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.9904 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8564 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 -1.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8564 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.7224 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 2.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 16.7224 3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5885 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 -3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6602 -1.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 1.5000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 3.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 17.5885 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 2 0 0 0 0 1 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 5 7 1 0 0 0 0 5 8 1 0 0 0 0 6 9 1 0 0 0 0 6 10 2 0 0 0 0 7 11 1 0 0 0 0 8 12 2 0 0 0 0 9 13 1 0 0 0 0 11 14 1 0 0 0 0 12 15 1 0 0 0 0 13 16 1 0 0 0 0 14 17 2 0 0 0 0 14 18 1 0 0 0 0 15 19 1 0 0 0 0 16 20 1 0 0 0 0 16 21 2 0 0 0 0 17 22 1 0 0 0 0 18 23 2 0 0 0 0 19 24 1 0 0 0 0 19 25 2 0 0 0 0 20 26 1 0 0 0 0 21 27 1 0 0 0 0 22 28 2 0 0 0 0 26 29 1 0 0 0 0 26 30 1 0 0 0 0 30 31 2 0 0 0 0 30 32 1 0 0 0 0 31 33 1 0 0 0 0 32 34 2 0 0 0 0 33 35 2 0 0 0 0 35 36 1 0 0 0 0 36 37 1 0 0 0 0 36 38 2 0 0 0 0 37 39 1 0 0 0 0 10 12 1 0 0 0 0 23 28 1 0 0 0 0 34 35 1 0 0 0 0 M CHG 2 1 1 2 -1 M END