IBS-ZINC02087271 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1980 -0.6360 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2490 -2.0260 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4600 -2.6700 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6460 -1.9260 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5890 -0.5270 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3730 0.1080 0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9450 -2.6100 0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9920 -3.8220 0.0280 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2200 -1.8070 0.0510 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.7490 -1.6240 -1.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0910 -2.2700 -1.3890 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8080 -2.3140 -2.3680 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.4020 -2.7960 -0.1980 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.3330 -2.5800 0.7770 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.9520 -3.5370 1.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8510 -1.7690 1.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7580 -0.7500 1.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2360 -0.0030 2.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8050 -0.2760 4.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8920 -1.3020 4.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4210 -2.0500 3.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4660 -1.5730 5.5510 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5280 -2.6400 5.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2740 0.4570 5.1110 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.6540 -3.4990 0.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4800 -4.9910 -0.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5180 -5.5430 0.7040 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1930 -1.0640 -2.2710 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3340 -2.5990 -0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4980 -3.7490 0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5010 0.0520 0.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3280 1.1860 0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.0940 -0.5360 0.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9450 0.7920 2.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7160 -2.8500 3.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2720 -2.7510 6.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9690 -3.5670 5.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6270 -2.4170 5.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0760 0.0990 5.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9130 -3.3610 1.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4500 -3.0980 -0.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4340 -5.5010 -0.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1340 -5.1240 -1.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3570 -6.4880 0.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0540 -0.8400 0.5270 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 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 11 50 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