IBS-ZINC02314540 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 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 -1.3390 -0.4990 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4980 -1.8490 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3860 -2.6770 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5420 -4.0470 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8230 -4.6040 -0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9440 -3.7690 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7790 -2.3970 0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8670 -1.5810 0.0420 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9930 -6.0680 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9510 -6.8420 -0.0280 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1120 -8.2340 -0.0350 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0300 -9.0370 -0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0830 -8.5560 -0.0580 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2040 -10.5340 -0.0580 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7640 -10.8310 -0.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9550 -10.9590 1.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3120 -11.2360 1.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9680 -11.6240 2.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3170 -11.7300 3.4180 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0270 -11.4750 3.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3040 -11.0880 2.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8790 -10.7880 -1.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2660 -11.4340 -1.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1220 -12.8530 -1.1080 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3840 -13.2700 0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9880 -12.6420 0.0050 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 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6050 -2.2480 -0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3260 -4.6900 -0.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9360 -4.1950 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1950 -1.3400 -0.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9840 -6.4970 -0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0020 -8.6190 -0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8510 -11.1500 0.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0250 -11.8410 2.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 -11.5720 4.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7540 -10.8840 2.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9840 -9.7030 -1.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3550 -11.1240 -2.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8150 -11.1920 -2.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8110 -11.0560 -0.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2950 -14.3560 0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9030 -12.9460 0.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4490 -13.0080 -0.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4420 -12.9120 0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1160 -11.1800 -0.0750 N 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 32 1 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 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 36 1 0 0 0 0 9 10 1 0 0 0 0 10 37 1 0 0 0 0 11 12 2 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 39 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 18 1 0 0 0 0 16 52 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 41 1 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 22 42 1 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 24 52 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 M END