IBS-ZINC02285828 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 53 0 0 0 0 0 0 0 0999 V2000 -0.4710 0.6600 3.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3720 -0.7190 3.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7320 -1.1050 2.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6380 -2.4140 1.8190 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7580 -2.9040 1.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7850 -2.2550 1.2750 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7380 -4.2270 0.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5370 -4.9320 0.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5250 -6.1680 -0.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6980 -6.7180 -0.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8910 -6.0350 -0.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9240 -4.7890 0.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1280 -4.1000 0.2270 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.2740 -4.7780 0.4340 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2460 -5.9810 0.6120 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5570 -4.0640 0.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1320 -3.6240 -0.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4150 -2.9160 -0.6830 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0350 -2.4540 -1.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2300 -1.7970 -1.7700 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.8340 -1.5820 -0.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.2420 -2.0280 0.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0240 -2.7010 0.5660 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4250 -3.1510 1.7250 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.2530 -3.8090 1.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7620 -4.1930 2.7520 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.0860 -2.9110 3.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0170 -4.0820 3.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5240 -3.8440 -1.9340 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4980 0.9350 4.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7670 1.3960 2.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2140 0.6320 4.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3710 -0.6910 2.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0760 -1.4560 3.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4760 -1.1330 3.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0280 -0.3690 1.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6200 -4.5080 0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5960 -6.7120 -0.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6780 -7.6880 -1.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8010 -6.4700 -0.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1410 -3.1330 0.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5700 -2.6170 -2.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7070 -1.4410 -2.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.7780 -1.0600 -0.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7200 -1.8550 1.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3350 -2.8180 3.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.6670 -1.9900 2.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.7680 -4.1750 2.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4360 -5.0020 3.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5090 -3.9030 4.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7250 -4.3850 -1.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 3 36 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 12 2 0 0 0 0 8 9 2 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 10 11 2 0 0 0 0 10 39 1 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 41 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 25 1 0 0 0 0 17 18 1 0 0 0 0 17 29 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 21 22 2 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 27 1 0 0 0 0 25 26 2 0 0 0 0 27 28 1 0 0 0 0 27 46 1 0 0 0 0 27 47 1 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 28 50 1 0 0 0 0 29 51 1 0 0 0 0 M END