IBS-ZINC02279332 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 42 0 0 0 0 0 0 0 0999 V2000 -0.0670 1.5350 -0.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0440 0.0050 -0.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4610 -0.5300 -0.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4400 -1.9810 -0.1480 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6150 -2.6130 0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6310 -1.9690 0.2100 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6700 -4.0870 0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8890 -4.7440 0.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9370 -6.1200 0.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7730 -6.8560 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5570 -6.2050 -0.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5040 -4.8300 -0.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8240 -8.2480 -0.0150 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9120 -8.8780 -0.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8060 -8.2370 -1.0160 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0190 -10.3640 -0.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1260 -11.0050 0.1080 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1070 -10.9940 -0.8920 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.2120 -12.4530 -0.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5330 -12.9100 -1.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6420 -14.4330 -1.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8760 -14.8600 -1.9040 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9420 1.9160 -0.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7230 1.9020 -1.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4360 1.8760 0.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3240 -0.3360 -1.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6110 -0.3620 0.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8300 -0.1880 0.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1160 -0.1620 -0.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7930 -4.1740 0.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8780 -6.6280 0.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6560 -6.7790 -0.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5610 -4.3250 -0.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0770 -8.7640 0.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8210 -10.4820 -1.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3800 -12.9110 -1.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1790 -12.7530 0.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3640 -12.4510 -0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5660 -12.6090 -2.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8110 -14.8920 -1.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6100 -14.7340 -0.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0130 -15.8170 -1.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 3 29 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 30 1 0 0 0 0 9 10 1 0 0 0 0 9 31 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 34 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 18 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 22 42 1 0 0 0 0 M END