IBS-ZINC04661974 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 40 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 0.6060 -0.6080 -1.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1660 0.1620 -2.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7840 -0.4470 -3.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8430 -1.8170 -3.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2830 -2.6110 -2.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6650 -1.9960 -1.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1210 -2.7500 -0.1340 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2490 -3.1280 -0.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4960 -4.0240 -2.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1280 -4.9700 -1.9040 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1560 -4.1200 -3.7400 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4260 -2.7670 -4.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5200 -5.2990 -4.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2740 -6.4790 -3.9110 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6930 -7.5350 -4.6370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5480 -8.9110 -4.3590 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0460 -9.8510 -5.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6980 -9.4650 -6.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8510 -8.1280 -6.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3520 -7.1600 -5.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3780 -5.4000 -5.8970 S 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 1.1220 1.2390 -2.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2190 0.1580 -3.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3660 -3.7120 -1.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5580 -3.7260 0.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8680 -2.2330 -0.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9440 -2.6240 -5.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5010 -2.6080 -4.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0430 -9.2260 -3.4580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9290 -10.9000 -5.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0870 -10.2130 -7.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3590 -7.8290 -7.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 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 27 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 6 7 2 0 0 0 0 6 14 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 15 16 2 0 0 0 0 15 23 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 34 1 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 20 21 2 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 M END