IBS-ZINC04029269 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2950 -0.6030 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1560 -2.1040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0990 -2.6810 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2280 -4.0580 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8990 -4.8600 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1560 -4.2870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2880 -2.9060 0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5230 -2.3400 0.0350 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6430 -3.2270 0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5980 -4.6850 -0.0390 C 0 0 3 0 0 0 0 0 0 0 0 0 2.3360 -3.9620 0.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9380 -5.1230 -1.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5100 -6.3150 -1.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6800 -6.3790 -3.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2080 -7.3540 -4.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2120 -7.0680 -5.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7180 -5.8740 -5.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1900 -4.8920 -5.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1730 -5.1540 -3.6680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7340 -4.4220 -2.6020 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3370 -3.5390 -2.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8750 -7.3320 -0.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8600 -6.6300 0.6900 C 0 0 3 0 0 0 0 0 0 0 0 0 3.7090 -5.9500 0.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9510 -7.6600 1.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9540 -8.0070 2.3730 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1410 -8.1910 2.1100 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1540 -9.1770 3.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8320 -0.2940 0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8490 -0.2840 -0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9800 -2.0570 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7960 -5.9350 -0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0350 -4.9140 0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6210 -3.8510 -0.8470 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5960 -3.8600 0.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5660 -2.6480 0.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5950 -8.2870 -3.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6120 -7.7980 -6.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7470 -5.7040 -6.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8100 -3.9650 -5.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1470 -8.1440 -0.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8700 -7.7280 -0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7750 -8.7260 4.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5220 -10.0210 2.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1740 -9.5240 3.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6110 -5.8670 0.8380 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4560 -5.6050 1.8000 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 3 4 1 0 0 0 0 3 34 1 0 0 0 0 3 35 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 36 1 0 0 0 0 6 7 1 0 0 0 0 6 12 1 0 0 0 0 7 8 2 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 11 41 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 51 1 0 0 0 0 14 15 2 0 0 0 0 14 22 1 0 0 0 0 15 16 1 0 0 0 0 15 24 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 42 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 19 20 2 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 51 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 30 1 0 0 0 0 30 48 1 0 0 0 0 30 49 1 0 0 0 0 30 50 1 0 0 0 0 51 52 1 0 0 0 0 M END