NCI:700854 BBtclserve11129920302D 0 0.00000 0.00000248713 Corina 01.500030 20.12.1994 28 31 0 0 0 0 0 0 0 0 1 V2000 2.3090 3.9166 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.9656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6691 2.2224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6473 2.4304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9563 3.3814 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2872 4.1246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9563 3.3814 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2653 2.4304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4563 1.8426 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5608 0.8481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4744 0.4413 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2834 1.0291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1789 2.0236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9879 2.6114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8833 3.6059 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9014 2.2047 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7104 2.7925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6240 2.3857 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7518 0.2603 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.5789 -0.5532 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7699 -1.1410 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8744 -2.1355 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7880 -2.5422 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5970 -1.9545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4925 -0.9599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8925 -3.5368 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8061 -3.9435 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0835 -4.1246 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 2 3 2 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 7 1 0 0 0 0 5 6 1 0 0 0 0 7 8 2 0 0 0 0 8 13 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 19 2 0 0 0 0 11 12 1 0 0 0 0 11 20 1 0 0 0 0 12 13 2 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 M END