CHEMBRIDGE-ZINC00453419 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 32 0 0 0 0 0 0 0 0999 V2000 0.0190 1.3360 -0.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1000 0.0110 -1.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3160 -0.6390 -1.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4680 0.0430 -0.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3790 1.3800 -0.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 2.0180 -0.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7740 -0.6470 -0.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8480 -1.8110 -1.1820 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8840 0.0150 -0.4560 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0760 -0.6150 -0.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1800 -2.2540 -0.9320 S 0 0 0 0 0 0 0 0 0 0 0 0 7.1850 0.0460 -0.0660 N 0 0 0 0 0 0 0 0 0 0 0 0 8.4080 -0.6310 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8060 -1.4860 -0.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0110 -2.1530 -0.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8250 -1.9700 0.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4280 -1.1150 1.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2260 -0.4430 1.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0110 -2.6280 0.2940 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9360 1.8420 -0.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7920 -0.5150 -1.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3780 -1.6730 -1.5490 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2660 1.9140 -0.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0860 3.0520 -0.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8250 0.9440 -0.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1370 0.9910 0.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1720 -1.6290 -1.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3210 -2.8180 -1.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0620 -0.9730 2.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9190 0.2260 1.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7580 -2.1460 -0.0880 H 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 1 20 1 0 0 0 0 2 3 2 0 0 0 0 2 21 1 0 0 0 0 3 4 1 0 0 0 0 3 22 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 23 1 0 0 0 0 6 24 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 25 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 26 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 27 1 0 0 0 0 15 16 1 0 0 0 0 15 28 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 29 1 0 0 0 0 18 30 1 0 0 0 0 19 31 1 0 0 0 0 M END