IBS-ZINC02402869 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 52 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.7020 1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0840 1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7680 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0710 -1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6890 -1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 -2.9440 -2.7370 S 0 0 0 0 0 0 0 0 0 0 0 0 0.5370 -2.0490 -3.7100 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5800 -4.2200 -2.4720 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6690 -3.2260 -3.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4830 -2.3640 -3.9470 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7930 -3.0220 -4.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7650 -2.4450 -4.7090 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5560 -1.2620 -5.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5920 -0.6380 -6.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3720 0.5640 -6.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1300 1.1910 -6.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1040 0.6180 -5.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2930 -0.6250 -5.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2910 -1.1950 -4.5360 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6820 -4.2040 -3.3350 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4080 -4.3090 -2.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9440 -5.3730 -2.0790 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7040 -5.1470 -3.1650 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8460 -6.1140 -4.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9150 -7.1020 -3.8450 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1630 -8.1540 -4.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2260 -8.9430 -4.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8470 -8.5570 -3.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0750 -7.1180 -2.5220 S 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1670 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6290 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -3.8480 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1440 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5600 -1.1110 -6.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1710 1.0380 -7.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9800 2.1440 -7.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1470 1.1150 -5.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0300 -5.3760 -1.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5340 -6.1150 -1.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1770 -6.1890 -4.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5740 -8.3540 -5.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5350 -9.8100 -4.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6970 -9.0570 -2.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 5 6 2 0 0 0 0 5 37 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 38 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 23 2 0 0 0 0 12 13 1 0 0 0 0 12 21 2 0 0 0 0 13 14 2 0 0 0 0 13 22 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 18 19 2 0 0 0 0 18 41 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 22 23 1 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 25 26 2 0 0 0 0 26 27 1 0 0 0 0 26 45 1 0 0 0 0 27 28 2 0 0 0 0 27 31 1 0 0 0 0 28 29 1 0 0 0 0 28 46 1 0 0 0 0 29 30 2 0 0 0 0 29 47 1 0 0 0 0 30 31 1 0 0 0 0 30 48 1 0 0 0 0 M END