NCI:160802 BBtclserve11129917572D 0 0.00000 0.00000118787 999-99-9 22 25 0 0 0 0 0 0 0 0 2 V2000 5.5491 3.1646 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8581 2.2135 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2704 1.4045 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8092 1.9045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8581 0.5955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8092 0.9045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7602 2.2135 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5491 -0.3556 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7603 0.5955 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3480 1.4045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.6646 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1369 -1.1646 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1571 1.9923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1571 0.8167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.6646 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.1646 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5491 -1.9736 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -2.1646 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.6646 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -3.1646 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.6646 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 2.0000 -2.1646 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 3 5 1 0 0 0 0 4 6 1 0 0 0 0 4 7 1 0 0 0 0 5 8 1 0 0 0 0 6 9 1 0 0 0 0 7 10 1 0 0 0 0 8 11 1 0 0 0 0 8 12 1 0 0 0 0 10 13 1 0 0 0 0 10 14 1 0 0 0 0 11 15 2 0 0 0 0 11 16 1 0 0 0 0 12 17 2 0 0 0 0 15 18 1 0 0 0 0 16 19 2 0 0 0 0 18 20 1 0 0 0 0 18 21 2 0 0 0 0 21 22 1 0 0 0 0 5 6 1 0 0 0 0 9 10 1 0 0 0 0 15 17 1 0 0 0 0 19 21 1 0 0 0 0 M CHG 2 21 1 22 -1 M END