NCI:113953 BBtclserve11129917302D 0 0.00000 0.00000 86805 20688-71-5 30 31 0 0 0 0 0 0 0 0 2 V2000 5.9543 -1.6343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9543 -1.6343 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6453 -0.6833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4543 -0.0955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2633 -0.6833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6942 -0.3743 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9511 -1.0434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.7344 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1590 -2.0215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3665 -2.4434 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7732 -3.3569 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1854 -4.1659 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7677 -3.4614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5421 -2.4434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5366 -2.3388 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.1244 -3.1479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1189 -3.0433 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7176 -4.0614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4543 0.9045 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2633 1.4923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9543 2.4433 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9543 2.4433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6453 1.4923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6942 1.1833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4863 0.2051 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9511 1.8524 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.5434 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3665 3.2524 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 4.7732 4.1659 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3720 3.1478 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 1 5 1 0 0 0 0 3 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 2 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 1 14 1 0 0 0 0 14 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 4 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 19 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 22 28 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 4 5 1 0 0 0 0 22 23 2 0 0 0 0 M CHG 2 28 1 30 -1 M END