IBS-ZINC02140497 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 1 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 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9440 -0.1820 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1620 -0.0340 -1.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6180 -0.8220 -2.0030 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4130 -1.9980 0.0050 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6490 -2.4710 -0.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4570 -2.6890 0.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4130 -2.0980 0.9610 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4370 -4.1960 0.4960 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2630 -4.5510 -0.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3120 -4.6960 1.4100 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3310 -4.2190 2.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3740 -6.2320 1.5010 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7100 -6.5730 2.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7530 -6.7690 1.7420 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.7620 -7.8370 1.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8420 -6.0800 0.8980 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.8760 -6.4450 -0.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6880 -4.6890 0.9620 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0350 -6.4150 1.6600 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6150 -6.3560 3.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2080 -6.5620 3.0870 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9400 -4.9770 3.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3430 -7.4340 3.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8380 -6.6410 0.2290 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2060 -5.6850 -0.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0660 -4.4680 0.7040 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5540 -6.2610 0.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2450 -5.3730 -1.5360 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 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -1.6010 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0170 -4.8130 3.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5980 -4.9270 4.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4370 -4.2090 3.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1260 -8.4140 3.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0040 -7.4030 4.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4170 -7.2510 3.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7540 -7.1790 -0.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3420 -5.5360 0.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5270 -6.4780 1.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7140 -4.9580 -1.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0360 -4.6500 -1.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4420 -6.2890 -2.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3050 1.2850 -1.4120 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7800 1.5570 -2.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 36 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 3 39 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 8 1 0 0 0 0 6 7 2 0 0 0 0 6 52 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 22 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 30 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 28 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 25 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 27 1 0 0 0 0 26 40 1 0 0 0 0 26 41 1 0 0 0 0 26 42 1 0 0 0 0 27 43 1 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 29 32 1 0 0 0 0 31 46 1 0 0 0 0 31 47 1 0 0 0 0 31 48 1 0 0 0 0 32 49 1 0 0 0 0 32 50 1 0 0 0 0 32 51 1 0 0 0 0 52 53 1 0 0 0 0 M END