NIH-ZINC03017292 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 30 0 0 1 0 0 0 0 0999 V2000 -0.0850 1.2270 -0.5250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0070 -0.1980 -0.2580 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1660 -0.8710 -0.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2130 -0.2880 -0.3470 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1640 -2.3530 0.0840 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4180 -2.5880 0.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8520 -3.1250 -1.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7830 -4.3620 -1.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0320 -3.7570 -0.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4940 -2.7800 0.5400 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1170 -2.3500 1.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5350 -1.6180 2.4340 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4960 -2.7640 1.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1900 -2.4970 3.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4680 -3.0050 3.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8100 -3.6660 1.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5240 -3.6790 0.8360 S 0 0 0 0 0 0 0 0 0 0 0 0 0.9200 1.6470 -0.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5760 1.3900 -1.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6590 1.7130 0.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1000 -2.5250 -2.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1940 -3.4310 -1.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0290 -4.7460 -2.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3350 -5.1400 -0.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6640 -3.2570 -1.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5930 -4.5340 0.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7770 -1.9420 3.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1460 -2.8800 3.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7720 -4.1260 1.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 10 1 0 0 0 0 7 8 1 0 0 0 0 7 21 1 0 0 0 0 7 22 1 0 0 0 0 8 9 1 0 0 0 0 8 23 1 0 0 0 0 8 24 1 0 0 0 0 9 10 1 0 0 0 0 9 25 1 0 0 0 0 9 26 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 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 27 1 0 0 0 0 15 16 2 0 0 0 0 15 28 1 0 0 0 0 16 17 1 0 0 0 0 16 29 1 0 0 0 0 M END