IBS-ZINC06719676 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 53 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 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 0.7430 -0.5120 1.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5000 -2.0100 1.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4830 -2.6270 0.6850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4910 -4.3450 1.0340 S 0 0 0 0 0 0 0 0 0 0 0 0 0.8400 -4.2190 2.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2720 -2.9230 2.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4050 -2.5010 3.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2190 -2.1590 4.1560 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6510 -2.4940 2.4900 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4080 -5.2820 2.7690 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9070 -6.5240 2.6180 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0430 -6.7100 1.8840 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5190 -7.6710 3.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4680 -7.4850 4.0840 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0180 -8.9130 3.2000 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6190 -10.0380 3.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8670 -11.3250 3.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4850 -12.4830 4.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0230 -12.8250 5.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5900 -13.8870 6.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6190 -14.6070 5.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0800 -14.2650 4.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5100 -13.2060 3.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4410 -1.9050 -0.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3400 -0.5000 0.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7170 -0.4980 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8110 -0.3190 1.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3620 -0.0090 2.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7990 -2.7660 1.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4000 -2.2150 3.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1660 -5.1340 3.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2590 -9.0620 2.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6640 -10.1390 3.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5560 -9.8580 4.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1790 -11.2240 3.8650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9300 -11.5050 2.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2200 -12.2620 6.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2300 -14.1530 7.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0630 -15.4360 6.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8840 -14.8280 3.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8680 -12.9420 2.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1750 -2.1100 -1.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4610 -2.2400 -0.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7400 -0.1210 -1.2660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7320 -1.5880 -1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1900 -0.1370 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 2 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 24 2 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 28 49 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 M END