NCI:49817 BBtclserve11129917032D 0 0.00000 0.00000 42645 848-94-2 22 24 0 0 0 0 0 0 0 0 1 V2000 5.8582 -3.0505 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8363 -3.2585 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5492 -2.0995 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1453 -4.2095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.7905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1369 -1.2905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.7905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -2.2905 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5491 -0.4815 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -0.2905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.7905 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 0.7095 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.7905 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.2905 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.2095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.2095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 2.7095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.7095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.2095 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 3.7095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 3.7095 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 4.2095 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 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 7 2 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 8 11 2 0 0 0 0 10 12 1 0 0 0 0 10 13 2 0 0 0 0 11 14 1 0 0 0 0 12 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 17 19 1 0 0 0 0 17 20 1 0 0 0 0 18 21 2 0 0 0 0 20 22 2 0 0 0 0 7 9 1 0 0 0 0 11 13 1 0 0 0 0 21 22 1 0 0 0 0 M END