IBS-ZINC02113938 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 52 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3840 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 1.1960 -0.6900 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3970 0.0120 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3720 1.4190 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1510 2.0940 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7730 1.8480 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5240 0.7360 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7200 -0.3710 -0.0350 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0340 -1.2890 -0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2750 3.2690 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3400 3.7850 1.4170 C 0 0 3 0 0 0 0 0 0 0 0 0 3.3620 3.6650 1.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7020 5.2400 1.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8360 6.0510 1.1520 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9390 5.6790 1.6500 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0480 4.7860 1.9580 C 0 0 3 0 0 0 0 0 0 0 0 0 7.6550 5.2300 2.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5560 3.4450 2.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3110 2.7310 3.0390 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3210 3.0050 2.1590 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9070 4.6040 0.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5410 5.9200 0.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0700 6.8120 -0.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9140 7.8870 -0.6220 N 0 0 0 0 0 0 0 0 0 0 0 0 8.7830 8.6600 -1.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9750 7.7090 0.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7850 6.4720 0.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7140 6.0260 1.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8020 6.7970 2.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9920 8.0200 1.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0930 8.4750 0.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9620 1.9070 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9290 -0.5510 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2010 -1.7700 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1280 3.1740 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6040 0.7170 -0.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2700 3.3030 -0.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5970 3.8950 -0.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1060 6.6340 1.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0660 2.1270 2.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6870 3.8680 0.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2820 4.2580 -0.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1610 6.6980 -1.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5720 5.0760 2.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5200 6.4520 2.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8580 8.6180 1.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2480 9.4280 0.0680 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 33 1 0 0 0 0 2 3 2 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 36 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 21 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 40 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 22 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 23 24 2 0 0 0 0 23 28 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 29 30 1 0 0 0 0 29 45 1 0 0 0 0 30 31 2 0 0 0 0 30 46 1 0 0 0 0 31 32 1 0 0 0 0 31 47 1 0 0 0 0 32 48 1 0 0 0 0 M END