IBS-ZINC02144642 MOE2007 3D CORINA 3.40 0006 02.08.2006 33 33 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.6960 1.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.1000 1.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7360 -0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -1.9660 -1.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6480 -1.1470 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -4.2400 -0.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0510 -4.6340 -1.5330 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0650 -2.8820 2.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 -2.2760 3.5720 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0910 -3.0530 4.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4020 -2.7880 5.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4500 -1.4200 5.9660 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7180 -1.0430 6.7180 S 0 0 0 0 0 0 0 0 0 0 0 0 2.5130 0.2710 7.2170 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0350 -2.1500 7.5510 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.0270 2.3860 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 -2.4490 -2.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9590 -4.6210 0.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8210 -4.6460 0.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0630 -5.5910 -1.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0790 -3.9620 2.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7490 -2.7570 5.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0130 -4.1140 4.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4580 -3.4320 6.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2430 -3.0000 4.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8570 0.1550 2.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8380 -0.9440 5.6920 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6970 -0.7070 6.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 18 1 0 0 0 0 4 5 1 0 0 0 0 4 10 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 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 25 1 0 0 0 0 10 11 2 0 0 0 0 10 26 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 27 1 0 0 0 0 12 28 1 0 0 0 0 13 14 1 0 0 0 0 13 29 1 0 0 0 0 13 30 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 2 0 0 0 0 15 32 1 0 0 0 0 18 31 1 0 0 0 0 32 33 1 0 0 0 0 M END