OTAVA-ZINC01317696 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3800 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 1.2030 -0.6810 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4050 0.0350 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4330 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 2.0950 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6910 -0.6800 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7120 -1.8920 -0.0410 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9840 0.0960 -0.0440 C 0 0 3 0 0 0 0 0 0 0 0 0 4.8360 1.0490 -0.5510 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0640 -0.7120 -0.7710 C 0 0 3 0 0 0 0 0 0 0 0 0 6.1560 -1.6950 -0.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3410 -0.0040 -0.6740 N 0 0 0 0 0 0 0 0 0 0 0 0 7.6210 0.7900 0.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1420 1.5740 0.4240 S 0 0 0 0 0 0 0 0 0 0 0 0 6.7560 0.9930 1.3760 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4430 0.3460 1.3970 C 0 0 3 0 0 0 0 0 0 0 0 0 4.4330 1.2500 2.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1790 0.6300 2.1180 F 0 0 0 0 0 0 0 0 0 0 0 0 4.8530 1.4780 3.4210 F 0 0 0 0 0 0 0 0 0 0 0 0 4.3430 2.4700 1.4280 F 0 0 0 0 0 0 0 0 0 0 0 0 5.5390 -0.9000 2.0900 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6830 -0.8710 -2.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9070 0.1630 -3.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5590 0.0210 -4.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9870 -1.1560 -4.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7620 -2.1950 -3.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1170 -2.0520 -2.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1990 -3.3530 -4.4270 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 1.9040 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9270 -0.5550 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2160 -1.7610 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3010 1.9930 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1450 3.1750 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9980 -0.1100 -1.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0050 1.5830 2.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8260 -0.8170 3.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3540 1.0840 -2.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7350 0.8300 -5.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7150 -1.2660 -5.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9460 -2.8610 -1.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8390 -4.0130 -4.7290 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 30 1 0 0 0 0 2 3 2 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 32 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 33 1 0 0 0 0 6 34 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 11 1 0 0 0 0 9 17 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 23 1 0 0 0 0 13 14 1 0 0 0 0 13 35 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 36 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 21 1 0 0 0 0 22 37 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 38 1 0 0 0 0 25 26 1 0 0 0 0 25 39 1 0 0 0 0 26 27 2 0 0 0 0 26 40 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 28 41 1 0 0 0 0 29 42 1 0 0 0 0 M END