OTAVA-ZINC04750061 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3780 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 1.2110 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3990 0.0310 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3780 1.4120 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1490 3.5930 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1550 4.0880 1.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2380 4.3610 2.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9820 4.7830 3.3880 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7350 4.8790 3.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2670 4.4140 2.4210 S 0 0 0 0 0 0 0 0 0 0 0 0 0.2780 5.3030 4.9690 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1580 5.6520 5.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3500 5.5960 5.7060 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6630 6.1120 7.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8060 6.4310 8.1330 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5960 6.8820 9.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6790 7.1840 10.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4690 7.6300 11.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1780 7.7750 12.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0970 7.4740 11.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3030 7.0330 9.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9750 8.2100 13.2880 F 0 0 0 0 0 0 0 0 0 0 0 0 1.2300 -2.0300 -0.0200 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3430 -0.4950 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.9670 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0290 3.9710 -0.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2490 3.9460 -0.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2420 4.2460 1.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6750 5.3480 5.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0430 7.0000 7.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0730 5.3190 7.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7100 6.3290 7.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6860 7.0710 9.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3110 7.8650 12.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9080 7.5870 11.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5410 6.8020 9.2900 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 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 4 5 2 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 6 7 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 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 9 32 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 33 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 16 34 1 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 23 40 1 0 0 0 0 M END