NCI:243007 BBtclserve11129918322D 0 0.00000 0.00000150987 65441-91-0 18 19 0 0 0 0 0 0 0 0 2 V2000 3.7321 0.0761 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.4239 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 1.0761 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.0761 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.4239 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7810 0.7671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4231 2.0271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7321 1.0761 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 2.0000 -1.9239 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -1.9239 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2321 2.6149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3198 0.2670 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0411 2.0271 0.0000 N 0 5 0 0 0 0 0 0 0 0 0 0 2.0000 -2.9239 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -2.9239 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8199 3.4239 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6443 3.4239 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.4239 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 2 4 2 0 0 0 0 2 5 1 0 0 0 0 3 6 1 0 0 0 0 3 7 1 0 0 0 0 3 8 1 0 0 0 0 5 9 2 0 0 0 0 5 10 1 0 0 0 0 7 11 1 0 0 0 0 8 12 2 0 0 0 0 8 13 1 0 0 0 0 9 14 1 0 0 0 0 10 15 2 0 0 0 0 11 16 1 0 0 0 0 11 17 1 0 0 0 0 14 18 2 0 0 0 0 11 13 1 0 0 0 0 15 18 1 0 0 0 0 M CHG 2 8 1 13 -1 M END