NCI:15106 BBtclserve11129916462D 0 0.00000 0.00000 14523 4543-33-3 25 27 0 0 0 0 0 0 0 0 2 V2000 8.6352 0.2725 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 9.5487 -0.1342 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 8.5306 1.2671 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8261 -0.3153 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9126 0.0915 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9307 -1.3098 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1036 -0.4963 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6036 1.0425 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1217 -1.8976 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2946 0.0915 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2081 -1.4908 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6036 1.0425 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2262 -2.8921 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 4.3164 -0.1164 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9344 1.7857 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1397 -3.2988 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4172 -3.4799 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 3.6473 0.6267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2435 2.7367 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 3.9563 1.5778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6691 0.4188 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 4.5743 3.4799 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2216 2.9446 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 2.0000 1.1619 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3601 -0.5323 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 2 0 0 0 0 1 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 5 7 1 0 0 0 0 5 8 1 0 0 0 0 6 9 2 0 0 0 0 7 10 1 0 0 0 0 7 11 2 0 0 0 0 8 12 1 0 0 0 0 9 13 1 0 0 0 0 10 14 2 0 0 0 0 12 15 2 0 0 0 0 13 16 2 0 0 0 0 13 17 1 0 0 0 0 14 18 1 0 0 0 0 15 19 1 0 0 0 0 15 20 1 0 0 0 0 18 21 1 0 0 0 0 19 22 2 0 0 0 0 19 23 1 0 0 0 0 21 24 2 0 0 0 0 21 25 1 0 0 0 0 9 11 1 0 0 0 0 10 12 1 0 0 0 0 18 20 2 0 0 0 0 M CHG 8 1 1 2 -1 13 1 17 -1 19 1 21 1 23 -1 25 -1 M END