IBS-ZINC02087271 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 1 0 0 0 0 0999 V2000 0.9300 -0.3190 -0.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0100 -0.0240 0.1920 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1920 -0.6520 0.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1330 -0.4080 1.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3540 -1.0420 1.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6480 -1.9330 0.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6980 -2.1750 -0.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4820 -1.5320 -0.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9520 -2.6140 0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0090 -3.9540 -0.1180 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1180 -1.8820 0.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2370 -0.4840 0.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6780 -0.1430 0.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.1240 0.9850 0.3680 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.4130 -1.2660 0.3880 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.5210 -2.4250 0.2880 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.7750 -3.0200 -0.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6340 -3.2680 1.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7670 -2.6600 2.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8710 -3.4290 3.9110 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8420 -4.8110 3.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7070 -5.4230 2.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6100 -4.6470 1.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6770 -6.7800 2.4870 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5380 -7.3380 1.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9430 -5.5690 4.9470 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.8690 -1.3220 0.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5200 -1.3360 -0.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1610 -2.5390 -1.5350 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3200 0.3120 0.0860 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8480 0.2480 -0.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 -1.3860 -0.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4860 -0.0450 -1.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9040 0.2800 1.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0830 -0.8520 1.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9210 -2.8620 -1.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7500 -1.7150 -1.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7900 -1.5830 2.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9750 -2.9520 4.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5100 -5.1190 0.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5280 -8.4260 1.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3740 -7.0200 0.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6040 -6.9930 0.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8510 -5.8010 5.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1460 -2.2280 1.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2130 -0.4490 1.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6030 -1.2880 -0.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1730 -0.4760 -1.4250 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5390 -2.6160 -2.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9080 -4.3100 -0.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 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 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 11 2 0 0 0 0 10 50 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 30 2 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 27 1 0 0 0 0 16 17 1 0 0 0 0 16 18 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 38 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 21 22 2 0 0 0 0 21 26 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 23 40 1 0 0 0 0 24 25 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 26 44 1 0 0 0 0 27 28 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 28 29 1 0 0 0 0 28 47 1 0 0 0 0 28 48 1 0 0 0 0 29 49 1 0 0 0 0 M END