IBS-ZINC00725009 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 45 0 0 0 0 0 0 0 0999 V2000 -0.4870 1.8090 -0.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2620 0.0130 -0.1470 S 0 0 0 0 0 0 0 0 0 0 0 0 0.5550 -0.3130 0.9700 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4920 -0.6610 -0.3760 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6680 -0.3770 -1.4600 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1370 -0.3770 -1.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6940 0.4620 -2.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1470 -0.0350 -3.7970 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6870 0.1210 -3.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0480 -0.7380 -2.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7560 0.5980 -4.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3780 0.2670 -6.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9790 0.8910 -7.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9620 1.8490 -7.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3400 2.1800 -5.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7340 1.5600 -4.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5720 2.4820 -8.1340 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8660 2.8500 -8.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5310 2.5490 -7.0870 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4730 3.6140 -9.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7700 4.0440 -9.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0740 4.7400 -10.3440 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0640 4.8760 -11.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6520 4.1170 -10.6260 S 0 0 0 0 0 0 0 0 0 0 0 0 0.4860 2.3000 -0.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9870 2.0490 -1.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0950 2.1560 0.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4470 0.0570 -0.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5080 -1.3990 -1.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4060 1.5050 -2.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7800 0.3830 -2.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4280 1.1690 -3.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3190 -0.2050 -4.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2230 -1.7940 -2.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0230 -0.5420 -2.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6150 -0.4780 -6.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6860 0.6340 -8.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1040 2.9240 -5.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0250 1.8210 -3.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0630 2.6540 -8.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4840 3.8560 -8.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0570 5.1470 -10.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1340 5.3940 -12.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 2 0 0 0 0 2 4 2 0 0 0 0 2 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 6 29 1 0 0 0 0 7 8 1 0 0 0 0 7 30 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 14 15 2 0 0 0 0 14 17 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 2 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 22 23 2 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 M END