IBS-ZINC06244441 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4610 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.8300 1.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0330 -0.6040 2.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -1.6700 3.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0670 -2.9770 2.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -3.2180 1.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0360 -2.1440 0.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 -2.0550 -0.7400 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 -0.8040 -1.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0300 -0.3140 -2.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 -0.1280 -3.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7200 0.3150 -5.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6370 0.7630 -6.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0520 2.0670 -6.5310 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 2.1380 -5.9610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8060 1.7030 -4.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0900 -4.0510 3.7660 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9120 -4.0490 5.0840 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.6780 -5.2730 5.7670 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7650 -2.7760 5.6990 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5660 -4.1240 4.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1740 -5.3490 4.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4710 -5.4070 3.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1620 -4.2410 3.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5560 -3.0160 3.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2590 -2.9570 4.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8380 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8220 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8120 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 0.4070 2.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 -1.4920 4.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0680 -4.2320 1.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5430 -1.0440 -3.1480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5580 0.6390 -2.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9160 0.6020 -2.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9300 -1.0810 -2.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1120 -0.7010 -4.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3800 0.9860 -4.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6380 0.7930 -6.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0200 0.0610 -7.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3730 3.1620 -6.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0710 1.4750 -6.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4350 2.3970 -3.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1980 1.7010 -4.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6920 -4.7960 3.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6340 -6.2610 4.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9460 -6.3650 3.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1760 -4.2860 3.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0950 -2.1040 3.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7860 -2.0000 4.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3760 0.3500 -4.4140 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 2 0 0 0 0 6 18 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 12 52 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 13 52 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 17 52 1 0 0 0 0 18 19 1 0 0 0 0 18 46 1 0 0 0 0 19 20 2 0 0 0 0 19 21 2 0 0 0 0 19 22 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 47 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 25 26 2 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 27 51 1 0 0 0 0 M END