IBS-ZINC04023275 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 51 0 0 0 0 0 0 0 0999 V2000 -0.6250 0.4590 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2720 -0.7680 -0.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0270 -0.9820 1.0130 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8780 -2.0390 1.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9870 -2.8550 -0.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8550 -3.9310 -0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6210 -4.2030 1.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5260 -3.4030 2.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6560 -2.3070 2.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5540 -1.4450 3.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6260 -1.9870 4.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6650 -3.4460 4.7470 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7090 -3.9980 5.0440 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5460 -4.1750 4.5670 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5580 -5.6150 4.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2090 -6.2180 4.4380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1790 -7.6760 4.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1380 -8.1800 5.3540 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6640 -1.1570 5.7110 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7090 -1.6970 6.9450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8080 -2.9010 7.0780 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6380 -0.8240 8.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6840 -1.3800 9.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6170 -0.5600 10.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5040 0.8100 10.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4570 1.3670 9.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5290 0.5590 7.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0070 1.3340 0.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 0.6220 -0.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3050 0.2950 0.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3460 -1.6430 -0.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9520 -0.6040 -1.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3930 -2.6510 -0.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9360 -4.5640 -0.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2950 -5.0460 1.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1250 -3.6190 3.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4210 -0.3800 3.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7320 -3.7450 4.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3510 -6.0860 4.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7350 -5.7860 5.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5920 -5.6910 4.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0690 -6.1220 3.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6570 -0.1930 5.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7720 -2.4500 9.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6520 -0.9890 11.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4520 1.4470 11.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3680 2.4370 8.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4980 0.9960 6.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9130 -8.4140 4.5680 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8860 -9.3440 4.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 2 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 19 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 17 18 2 0 0 0 0 17 49 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 25 26 2 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 27 48 1 0 0 0 0 49 50 1 0 0 0 0 M END