IBS-ZINC02122946 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 55 0 0 0 0 0 0 0 0999 V2000 2.8580 0.2950 0.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9190 -0.7540 0.4810 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5760 -0.9870 -0.8130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1300 -0.2220 -1.8270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7790 -0.4590 -3.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8750 -1.4590 -3.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3160 -2.2290 -2.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6670 -2.0020 -1.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0740 -2.8290 -0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0470 -4.2290 -0.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5210 -4.9880 0.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0340 -4.3300 1.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9680 -2.9400 2.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4190 -2.2470 1.0290 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5090 -2.2260 3.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0070 -2.8520 4.1140 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4490 -0.8810 3.2570 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9850 -0.1730 4.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7960 1.3110 4.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7760 2.0720 3.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5590 3.4340 3.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3820 3.9830 3.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4720 3.2280 4.5300 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6470 1.9310 4.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4110 -6.3990 0.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7860 -7.6020 1.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5410 -8.7920 0.3950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -8.7950 -0.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4550 -7.6120 -1.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2150 -6.4000 -0.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4800 -5.0900 -1.1600 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9100 -4.8170 -1.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7920 0.0740 0.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4530 1.2380 0.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0440 0.3750 1.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8350 0.5600 -1.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2120 0.1400 -3.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6070 -1.6380 -4.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3890 -3.0080 -2.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4760 -4.8880 2.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0510 -0.3810 2.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0470 -0.3940 4.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4580 -0.4990 5.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6860 1.6160 3.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3000 4.0570 2.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2050 5.0420 3.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1190 1.3450 5.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2680 -7.6030 2.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8310 -9.7260 0.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2670 -9.7330 -1.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9370 -7.6260 -2.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 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 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 14 2 0 0 0 0 10 11 2 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 11 25 1 0 0 0 0 12 13 2 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 22 23 2 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 48 1 0 0 0 0 27 28 1 0 0 0 0 27 49 1 0 0 0 0 28 29 2 0 0 0 0 28 50 1 0 0 0 0 29 30 1 0 0 0 0 29 51 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 M END