IBS-ZINC02137191 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 46 0 0 0 0 0 0 0 0999 V2000 -0.0160 1.3060 0.0090 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 1.3170 -0.7400 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2770 -1.8090 0.9330 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3840 -2.5720 1.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3580 -2.3340 0.3530 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4140 -3.6490 1.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8470 -3.5920 3.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6890 -4.9540 3.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0020 -5.2210 5.1250 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4620 -4.2460 5.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 -4.5210 7.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2670 -3.5240 8.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4170 -2.2260 7.5700 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1010 -1.9210 6.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6150 -2.9260 5.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3020 -2.6380 4.1560 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2000 -5.7280 2.8330 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0310 -4.9700 1.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5500 -5.5120 0.5420 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4450 -4.9420 -0.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2200 -6.8150 0.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7970 -7.2770 -0.5910 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3840 -7.6680 1.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8850 -7.0880 2.8170 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0470 -7.8680 3.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7300 -9.2120 3.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2500 -9.7890 2.7470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0610 -9.0230 1.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9120 1.8580 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9580 1.8330 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4950 -1.1440 -1.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1210 -0.0520 0.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6890 -5.5210 7.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5240 -3.7410 9.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7890 -1.4520 8.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2220 -0.9110 5.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4220 -7.4270 4.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8570 -9.8180 4.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0060 -10.8410 2.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6820 -9.4740 0.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 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 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 19 2 0 0 0 0 8 9 1 0 0 0 0 8 17 2 0 0 0 0 9 10 2 0 0 0 0 9 18 1 0 0 0 0 10 11 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 35 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 14 15 2 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 18 19 1 0 0 0 0 18 25 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 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 24 29 2 0 0 0 0 25 26 2 0 0 0 0 26 27 1 0 0 0 0 26 39 1 0 0 0 0 27 28 2 0 0 0 0 27 40 1 0 0 0 0 28 29 1 0 0 0 0 28 41 1 0 0 0 0 29 42 1 0 0 0 0 M END