IBS-ZINC02373261 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 1 0 0 0 0 0999 V2000 -0.6370 -0.0740 4.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4750 -1.1870 3.1800 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5210 -1.5990 2.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6010 -1.0460 2.5450 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3600 -2.7100 1.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4420 -3.1370 0.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4680 -4.2230 -0.0930 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5610 -4.5230 -0.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6320 -5.4780 -1.5170 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7140 -3.5740 -0.5420 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.9980 -3.0810 -1.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0380 -2.3700 0.6510 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.9100 -4.3140 0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0820 -3.3730 0.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9750 -3.2610 -0.8830 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0500 -2.3980 -0.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2330 -1.6470 0.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3400 -1.7600 1.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2670 -2.6260 1.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5360 -0.9550 2.6370 N 0 3 0 0 0 0 0 0 0 0 0 0 -9.4830 -0.1940 2.7220 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.7490 -1.0550 3.5620 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.3270 -5.0260 -0.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1060 -6.0660 0.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 -6.8560 0.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9260 -6.6120 -0.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7090 -5.5770 -1.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4180 -4.7880 -1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0900 -3.3600 1.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9170 -3.8760 1.2720 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3090 0.1150 4.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9410 0.8200 3.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4000 -0.3270 4.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3840 -1.6270 3.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1760 -5.1560 -0.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6470 -4.6810 1.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8320 -3.8480 -1.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7480 -2.3100 -1.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0720 -0.9720 0.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5720 -2.7170 2.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8130 -6.2560 1.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1930 -7.6650 1.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8060 -7.2320 -0.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4190 -5.3890 -2.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5900 -3.9820 -1.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 2 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 12 1 0 0 0 0 7 8 1 0 0 0 0 7 23 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 13 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 18 2 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 40 1 0 0 0 0 20 21 2 0 0 0 0 20 22 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 41 1 0 0 0 0 25 26 1 0 0 0 0 25 42 1 0 0 0 0 26 27 2 0 0 0 0 26 43 1 0 0 0 0 27 28 1 0 0 0 0 27 44 1 0 0 0 0 28 45 1 0 0 0 0 29 30 3 0 0 0 0 M CHG 1 20 1 M CHG 1 22 -1 M END