IBS-ZINC05452077 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 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 0.5120 -0.3550 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7340 -0.5030 1.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1110 -0.3310 1.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8390 -0.7570 2.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1820 -1.3620 3.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8120 -1.5340 3.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0840 -1.1100 2.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4020 -1.3580 2.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1110 -0.4470 1.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3740 -0.5110 0.0100 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0720 -1.1300 -1.3580 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.4770 -1.0050 -1.1830 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3730 -0.5630 -2.4570 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7260 -2.8570 -1.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6010 -3.7440 -0.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3370 -5.0980 -0.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1810 -5.5730 -1.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3010 -4.6700 -2.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5820 -3.3200 -2.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8910 -7.0150 -1.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6550 -7.7950 -0.9230 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3560 -7.5230 -2.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8850 -1.7820 4.5150 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1430 -2.3930 5.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1880 -0.5880 2.3950 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7910 0.0400 1.2620 C 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 2.6180 0.1400 0.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3010 -2.0020 4.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5930 -2.3980 2.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7920 -1.1660 3.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1350 -0.7890 1.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1150 0.5780 1.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4940 -3.3760 -0.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0210 -5.7890 -0.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5940 -5.0290 -2.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0940 -2.6220 -2.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1730 -7.5550 -1.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1760 -8.5250 -2.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6210 -6.8560 -2.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4070 -1.6870 5.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6330 -3.2790 5.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8220 -2.6810 6.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8680 0.1140 1.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5930 -0.5530 0.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3740 1.0390 1.1350 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 2 4 1 0 0 0 0 2 12 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 32 1 0 0 0 0 6 7 1 0 0 0 0 6 27 1 0 0 0 0 7 8 2 0 0 0 0 7 25 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 2 0 0 0 0 13 16 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 38 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 41 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 25 26 1 0 0 0 0 26 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