NCI:691595 BBtclserve11129920252D 0 0.00000 0.00000245254 999-99-9 36 39 0 0 0 0 0 0 0 0 2 V2000 4.5981 -0.3284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.6716 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 3.7891 1.2593 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0981 2.2104 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0981 2.2104 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4071 1.2593 0.0000 N 0 5 0 0 0 0 0 0 0 0 0 0 7.9128 0.0080 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.2437 -0.7352 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.3284 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 6.4347 0.6661 0.0000 N 0 5 0 0 0 0 0 0 0 0 0 0 7.4128 0.8740 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.8284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8380 0.9503 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4516 -1.7133 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8196 1.7875 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6859 3.0194 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.8284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.3284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.3284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -3.8284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -3.3284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -2.3284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -0.8284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -1.8284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.3284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.8284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.8284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.3284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9073 -0.0966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9019 -0.2011 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8028 -1.0911 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0119 0.8979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5103 3.0194 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9225 3.8284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7013 2.4316 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3193 3.6072 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 2 6 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 7 11 1 0 0 0 0 1 12 1 0 0 0 0 3 13 2 0 0 0 0 8 14 2 0 0 0 0 11 15 2 0 0 0 0 5 16 2 0 0 0 0 12 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 17 22 2 0 0 0 0 1 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 23 28 2 0 0 0 0 7 29 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 29 32 1 0 0 0 0 4 33 1 0 0 0 0 33 34 1 0 0 0 0 33 35 1 0 0 0 0 33 36 1 0 0 0 0 5 6 1 0 0 0 0 10 11 1 0 0 0 0 9 12 2 0 0 0 0 21 22 1 0 0 0 0 27 28 1 0 0 0 0 M CHG 4 2 1 6 -1 9 1 10 -1 M END