IBS-ZINC05244791 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 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 -0.3580 -0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7350 -0.5160 1.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 0.0300 2.5090 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2460 1.1000 2.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3850 -0.2050 2.4080 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0370 -0.4600 1.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3040 -0.6210 1.5200 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5000 -0.4750 2.8390 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3480 -0.2180 3.4170 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7320 -0.5780 3.4930 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.8480 -0.8470 2.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7850 -0.9990 1.5860 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.1760 -0.9590 3.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2550 -1.2620 2.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5680 -2.5740 2.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5580 -2.8530 1.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2360 -1.8190 0.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.9240 -0.5080 0.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9370 -0.2290 1.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3810 -0.5180 0.0210 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6000 -0.6780 3.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2320 0.0440 4.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7320 -0.6050 5.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6000 -1.9760 5.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9680 -2.6980 4.9540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4640 -2.0480 3.8430 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 0.7070 -1.6050 1.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7720 -0.1810 1.2210 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7820 -0.4570 4.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1300 -1.7610 4.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4010 -0.0180 3.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0380 -3.3820 2.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8020 -3.8780 1.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0090 -2.0370 -0.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4530 0.3000 0.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6960 0.7960 2.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8050 -0.8770 -0.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3350 1.1150 4.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2260 -0.0420 6.6090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9920 -2.4840 6.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8650 -3.7690 5.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0330 -2.6120 3.0670 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 22 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 23 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 2 0 0 0 0 8 22 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 15 36 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 37 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 19 20 2 0 0 0 0 19 39 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 42 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 26 27 2 0 0 0 0 26 45 1 0 0 0 0 27 28 1 0 0 0 0 27 46 1 0 0 0 0 28 47 1 0 0 0 0 M END