IBS-ZINC00702905 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 61 0 0 1 0 0 0 0 0999 V2000 -0.1450 1.1450 -0.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3690 0.9440 2.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8700 3.0470 1.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8520 3.4800 2.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7520 4.9280 2.3600 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6070 5.9470 1.7400 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.6460 5.7930 2.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1140 7.2800 2.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0790 7.0190 3.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8640 5.5580 3.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0110 5.0080 3.8170 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3580 7.9480 3.7550 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6540 8.6010 1.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9300 9.4460 1.4230 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0750 8.9060 2.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8730 7.9910 2.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1980 8.2780 3.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7480 9.4750 2.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9560 10.3930 1.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6240 10.1120 1.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4780 11.5720 1.5380 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.9050 11.6590 1.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4830 11.0960 2.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0600 9.7340 2.9030 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4760 5.8890 0.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6620 6.7900 -0.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5420 6.7370 -1.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2360 5.7820 -2.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0510 4.8780 -1.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1690 4.9260 -0.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9660 4.0350 0.1660 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5660 3.0080 -0.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1760 0.0580 -0.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8910 1.4740 -0.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5960 1.5780 -1.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6800 1.2100 2.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4600 -0.1380 2.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9390 1.2860 3.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1600 3.4960 0.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1350 3.3750 1.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8680 3.2250 1.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6120 2.9670 3.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3460 7.5780 4.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4510 7.0590 3.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8140 7.5700 3.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0100 10.8240 1.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2050 12.7000 1.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2690 11.0740 0.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1130 11.6760 3.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5710 11.1420 2.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1200 7.5370 0.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9060 7.4430 -2.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1400 5.7420 -3.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5920 4.1330 -2.4260 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1280 3.4610 -1.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7880 2.3630 -1.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2390 2.4170 -0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8910 1.5830 0.9460 N 0 0 0 0 0 0 0 0 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 58 1 0 0 0 0 2 36 1 0 0 0 0 2 37 1 0 0 0 0 2 38 1 0 0 0 0 2 58 1 0 0 0 0 3 4 1 0 0 0 0 3 39 1 0 0 0 0 3 40 1 0 0 0 0 3 58 1 0 0 0 0 4 5 1 0 0 0 0 4 41 1 0 0 0 0 4 42 1 0 0 0 0 5 6 1 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 25 1 0 0 0 0 8 9 2 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 10 11 2 0 0 0 0 12 43 1 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 20 2 0 0 0 0 16 17 2 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 18 19 2 0 0 0 0 18 24 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 23 24 1 0 0 0 0 23 49 1 0 0 0 0 23 50 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 51 1 0 0 0 0 27 28 1 0 0 0 0 27 52 1 0 0 0 0 28 29 2 0 0 0 0 28 53 1 0 0 0 0 29 30 1 0 0 0 0 29 54 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 32 55 1 0 0 0 0 32 56 1 0 0 0 0 32 57 1 0 0 0 0 M END