NCI:156253 BBtclserve11129917542D 0 0.00000 0.00000115419 1175-42-4 29 31 0 0 0 0 0 0 0 0 2 V2000 6.2160 -2.6307 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3500 -3.1307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0820 -3.1307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4839 -2.6307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9480 -2.6307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0820 -4.1307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3794 -1.6362 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5704 -3.0374 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9480 -1.6307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8141 -3.1307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9480 -4.6307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4013 -1.4283 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9013 -2.2943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8141 -1.1307 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0820 -1.1307 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8140 -4.1307 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9945 -0.5147 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 8.8141 -0.1307 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.4102 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5823 0.2943 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 9.6801 0.3693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6801 1.3693 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8711 1.9571 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4891 1.9571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1801 2.9081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1801 2.9081 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5923 3.7172 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 8.9991 4.6307 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5978 3.6126 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 1 0 0 0 0 2 4 1 0 0 0 0 3 5 2 0 0 0 0 3 6 1 0 0 0 0 4 7 1 0 0 0 0 4 8 2 0 0 0 0 5 9 1 0 0 0 0 5 10 1 0 0 0 0 6 11 2 0 0 0 0 7 12 1 0 0 0 0 8 13 1 0 0 0 0 9 14 1 0 0 0 0 9 15 2 0 0 0 0 10 16 2 0 0 0 0 12 17 1 0 0 0 0 14 18 1 0 0 0 0 17 19 2 0 0 0 0 17 20 1 0 0 0 0 18 21 2 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 24 2 0 0 0 0 23 25 1 0 0 0 0 24 26 1 0 0 0 0 25 27 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 12 13 2 0 0 0 0 11 16 1 0 0 0 0 25 26 2 0 0 0 0 M CHG 4 17 1 20 -1 27 1 29 -1 M END