IBS-ZINC02334534 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 50 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 3 0 0 0 0 0 0 0 0 0 0.4960 -0.3860 -0.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6220 -0.5390 1.2280 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4870 -1.6140 1.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4400 -0.1340 2.3320 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4150 0.9200 2.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1330 -1.0290 3.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4780 -1.6520 4.2440 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4890 -0.9890 3.2210 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8360 -0.4540 2.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9140 -0.0140 1.6650 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4570 -1.4500 4.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7510 -2.9110 3.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7850 -3.2870 3.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0560 -4.6270 2.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2930 -5.5920 3.5880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2580 -5.2140 4.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9920 -3.8740 4.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5570 -6.9020 3.3880 F 0 0 0 0 0 0 0 0 0 0 0 0 -1.7080 -0.5190 1.5920 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.8330 0.4430 1.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9820 1.7990 1.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1670 2.4200 2.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2000 1.6760 2.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0560 0.3170 2.7530 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8650 -0.3160 2.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4830 -1.6560 2.4930 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2320 -1.8600 2.0390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6420 -2.9180 1.9970 O 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 3.3780 -0.8750 4.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0420 -1.3110 5.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3800 -2.5340 2.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8630 -4.9200 2.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6620 -5.9660 4.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1870 -3.5790 5.2920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1720 2.3780 1.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2850 3.4840 1.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1260 2.1600 2.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8670 -0.2580 3.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0530 -2.3590 2.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3910 -0.5740 0.1460 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0580 -0.0350 -0.3850 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 4 1 0 0 0 0 2 45 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 11 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 21 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 13 1 0 0 0 0 11 12 2 0 0 0 0 13 14 1 0 0 0 0 13 34 1 0 0 0 0 13 35 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 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 19 39 1 0 0 0 0 21 22 1 0 0 0 0 21 29 1 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 24 41 1 0 0 0 0 25 26 2 0 0 0 0 25 42 1 0 0 0 0 26 27 1 0 0 0 0 26 43 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 44 1 0 0 0 0 29 30 2 0 0 0 0 45 46 1 0 0 0 0 M END