IBS-ZINC05451307 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 53 0 0 0 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 0.6520 -0.5700 -1.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6130 -2.0970 -1.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3090 -2.7030 -2.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2720 -4.1640 -2.1690 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8280 -4.9160 -3.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3590 -4.3820 -4.0900 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7900 -6.4190 -3.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4560 -7.0000 -4.2130 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8010 -7.3030 -4.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8440 -7.1700 -3.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1180 -7.5630 -3.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3770 -8.0950 -4.9800 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3560 -8.2350 -5.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0600 -7.8400 -5.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7790 -7.8520 -6.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8270 -7.3300 -5.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4970 -7.2330 -5.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3590 -6.7780 -5.1060 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1620 -7.6500 -7.1070 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1400 -8.1500 -7.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3970 -8.2390 -7.5010 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4610 -8.6150 -9.4730 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.2500 -8.1290 -9.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1850 -7.5960 -7.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6400 -8.4780 -5.3080 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6490 -8.3060 -4.3110 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 0.1380 -0.2510 -2.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6880 -0.2340 -1.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1260 -2.4160 -0.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4230 -2.4330 -1.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7950 -2.3830 -3.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3450 -2.3670 -2.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8470 -4.5920 -1.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3030 -6.7390 -2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7530 -6.7550 -3.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6540 -6.7580 -2.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9220 -7.4560 -3.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5580 -8.6470 -6.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5820 -7.3490 -9.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9120 -8.9930 -9.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8520 -8.1860 -7.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5270 -6.5600 -7.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7220 -7.2510 -4.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3870 -8.8850 -3.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6070 -8.6510 -4.7000 H 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 3 4 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 39 1 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 10 18 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 14 15 2 0 0 0 0 14 27 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 23 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 26 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 26 46 1 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 28 50 1 0 0 0 0 M END