NCI:372667 BBtclserve11129919182D 0 0.00000 0.00000187297 33611-85-7 68 70 0 0 0 0 0 0 0 0 1 V2000 3.7320 3.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 4.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 4.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 4.7500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 5.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 4.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 5.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 6.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 6.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 4.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 6.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 5.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1961 4.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 4.7500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 4.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 4.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6602 4.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6602 3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 3.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 1.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.2583 2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2583 1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1243 3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1243 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9904 2.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.1243 4.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.1243 0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9904 -0.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.2583 -0.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.9904 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1243 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8564 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1243 -2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8564 -2.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 16.7224 -1.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.2583 -3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2583 -4.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 -2.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 -4.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5262 -4.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 -5.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6602 -4.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5262 -6.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.2583 -6.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -4.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -4.7500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -3.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0621 -4.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0621 -3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1961 -4.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1961 -2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -4.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1961 -5.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1961 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -1.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -1.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5980 -3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5980 -4.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -4.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -4.7500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 4 7 2 0 0 0 0 5 8 1 0 0 0 0 5 9 2 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 10 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 16 18 1 0 0 0 0 17 19 2 0 0 0 0 18 20 2 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 27 1 0 0 0 0 26 28 2 0 0 0 0 26 29 1 0 0 0 0 27 30 1 0 0 0 0 30 31 1 0 0 0 0 30 32 2 0 0 0 0 31 33 1 0 0 0 0 33 34 1 0 0 0 0 33 35 1 0 0 0 0 34 36 1 0 0 0 0 35 37 2 0 0 0 0 35 38 1 0 0 0 0 36 39 1 0 0 0 0 39 40 1 0 0 0 0 39 41 2 0 0 0 0 40 42 1 0 0 0 0 42 43 1 0 0 0 0 42 44 1 0 0 0 0 43 45 1 0 0 0 0 44 46 2 0 0 0 0 44 47 1 0 0 0 0 45 48 1 0 0 0 0 48 49 1 0 0 0 0 48 50 2 0 0 0 0 49 51 1 0 0 0 0 51 52 1 0 0 0 0 51 53 1 0 0 0 0 52 54 1 0 0 0 0 53 55 2 0 0 0 0 53 56 1 0 0 0 0 54 57 1 0 0 0 0 57 58 1 0 0 0 0 57 59 2 0 0 0 0 58 60 1 0 0 0 0 60 61 1 0 0 0 0 60 62 1 0 0 0 0 61 63 1 0 0 0 0 62 64 2 0 0 0 0 62 65 1 0 0 0 0 63 66 1 0 0 0 0 66 67 2 0 0 0 0 66 68 1 0 0 0 0 7 9 1 0 0 0 0 10 12 1 0 0 0 0 19 20 1 0 0 0 0 M END