IBS-ZINC05343043 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 54 0 0 1 0 0 0 0 0999 V2000 0.2430 1.9780 -0.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4300 0.4650 -0.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9050 -0.1860 0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3120 -0.4560 1.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5370 -1.0540 1.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3600 -1.3830 0.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9580 -1.1160 -0.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7310 -0.5110 -0.9890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3240 -0.2320 -2.3000 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6440 0.9580 -2.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2740 1.7600 -2.1700 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2450 1.3080 -4.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5740 2.5440 -4.7610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1810 2.8350 -6.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4630 1.9140 -6.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1280 0.6860 -6.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5150 0.3740 -4.9650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1820 -0.9250 -4.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5300 -1.8800 -5.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7130 -3.1140 -4.4990 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5520 -4.0970 -5.1890 C 0 0 3 0 0 0 0 0 0 0 0 0 2.3760 -3.5940 -5.6960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1010 -5.1220 -4.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6840 -6.3180 -4.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7400 -6.3730 -6.5250 S 0 0 0 0 0 0 0 0 0 0 0 0 2.6160 -6.1140 -7.6140 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9180 -7.5320 -6.5390 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7040 -4.8920 -6.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6270 -1.1660 -2.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3650 -2.2250 -2.4260 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2100 2.4490 -0.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4260 2.1900 -1.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1870 2.3720 0.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8610 0.0700 -1.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1000 0.2530 0.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6720 -0.2000 2.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8530 -1.2640 2.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3160 -1.8500 0.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6010 -1.3740 -1.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1330 3.2680 -4.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4360 3.7920 -6.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1630 2.1590 -7.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4310 -0.0280 -6.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9420 -1.6480 -6.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2890 -3.3440 -3.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8830 -4.6600 -3.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2950 -5.4650 -3.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7430 -6.1570 -5.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5410 -7.2410 -4.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2570 -5.1750 -5.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5660 -4.3170 -7.1310 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 34 1 0 0 0 0 2 35 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 36 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 6 7 2 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 29 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 15 16 2 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 29 1 0 0 0 0 19 20 1 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 21 23 1 0 0 0 0 21 28 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 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 24 49 1 0 0 0 0 25 26 2 0 0 0 0 25 27 2 0 0 0 0 25 28 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 29 30 2 0 0 0 0 M END