COMGENEX-ZINC06774406 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.6380 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2550 -2.0240 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4790 -2.6650 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6480 -1.9270 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5960 -0.5450 0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3740 0.1010 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9810 -2.6290 0.0350 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.9110 -3.5920 -0.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0140 -1.7900 -0.5880 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.1890 -1.6920 0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0930 -1.0250 -0.4340 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.3400 -2.4610 1.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5920 -2.8410 1.7550 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.7560 -1.0820 -1.8450 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1450 -1.9770 -3.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4620 -1.9920 -5.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3290 -1.1370 -6.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9190 -0.7510 -6.8450 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2320 -0.1420 -5.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4470 -1.0370 -4.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2730 -0.9490 -8.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8550 -1.4530 -8.9490 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8270 -0.5460 -8.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1500 -0.7980 -9.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7920 -1.6640 -8.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3430 -2.6010 -0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5220 -3.7440 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5100 0.0290 0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3340 1.1800 0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8060 -1.8410 2.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9070 -3.3780 1.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3450 -0.1660 -1.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6960 -0.8350 -1.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5550 -2.8940 -2.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2040 -2.2250 -2.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5150 -2.1960 -5.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9290 -2.9330 -5.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6500 -1.7130 -7.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9450 -0.2430 -6.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1650 -0.0610 -5.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6460 0.8480 -5.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9420 -1.9910 -4.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0380 -0.5480 -3.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5330 0.3460 -7.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7500 -1.2550 -10.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4100 -0.0710 -9.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8170 -1.5070 -7.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1570 -2.6910 -8.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8850 -1.2680 -4.2830 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 15 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 17 54 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 18 54 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 22 54 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 M END