NCI:623081 BBtclserve11129919402D 0 0.00000 0.00000212745 999-99-9 45 48 0 0 0 0 0 0 0 0 1 V2000 13.5232 -3.0202 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9785 -2.1815 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1399 -2.7262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8172 -1.6369 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4339 -1.3429 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4353 -1.3952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8906 -0.5565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3446 0.3345 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3432 0.3868 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8879 -0.4519 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1835 -1.2636 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 10.3088 -2.2558 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.8906 -1.9707 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2925 -1.7176 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.5010 1.3222 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.3446 2.3099 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8906 3.2009 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1835 3.9080 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7190 3.2008 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2650 2.3098 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1086 1.3221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1750 1.6805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3978 1.0512 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5543 0.0635 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4879 -0.2949 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2650 0.3345 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7190 -0.5566 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.2933 -1.4614 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8280 -1.0105 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4261 -1.2637 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1478 0.2113 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7771 -0.5658 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.1952 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4065 -1.3430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3171 -1.7176 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0462 -3.4284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6878 -2.4948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0339 -3.5848 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6632 -2.8077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3048 -1.8741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2925 4.3619 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3048 4.5184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3171 4.3619 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4261 3.9079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3922 -4.5184 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 5 10 2 0 0 0 0 7 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 2 0 0 0 0 11 14 1 0 0 0 0 8 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 21 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 27 29 2 0 0 0 0 27 30 1 0 0 0 0 24 32 1 0 0 0 0 32 33 1 0 0 0 0 32 34 1 0 0 0 0 30 35 1 0 0 0 0 35 37 2 0 0 0 0 36 38 2 0 0 0 0 38 39 1 0 0 0 0 14 40 1 0 0 0 0 18 41 1 0 0 0 0 41 42 1 0 0 0 0 42 43 1 0 0 0 0 19 44 1 0 0 0 0 38 45 1 0 0 0 0 9 10 1 0 0 0 0 25 26 2 0 0 0 0 31 32 1 0 0 0 0 36 37 1 0 0 0 0 39 40 2 0 0 0 0 35 40 1 0 0 0 0 43 44 1 0 0 0 0 M END