IBS-ZINC04869502 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 62 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.6980 1.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0640 1.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.7680 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -2.0700 -1.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6790 -1.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 -3.0110 -2.2150 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0110 -2.8120 -3.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0440 -4.2680 -1.6750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 -4.1910 -0.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0810 -5.3490 0.6290 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3520 -4.9900 1.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3030 -5.9990 0.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5390 -7.8540 1.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4740 -8.9840 2.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3090 -8.4100 4.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0810 -7.6070 4.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1460 -6.4760 3.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3170 -9.4090 4.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3610 -10.4170 4.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3720 -11.4030 5.9160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3320 -11.3890 6.9110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2850 -10.3870 6.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2770 -9.3940 5.9820 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3110 -8.2990 6.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3300 -10.3750 8.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0430 -6.3120 0.1920 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0540 -5.5500 -2.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1530 2.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -2.5960 2.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0270 -0.1310 -2.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0500 -5.2440 0.9290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5360 -6.4370 -0.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6330 -8.2780 0.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4020 -7.2210 1.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3960 -9.5630 2.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6270 -9.6320 2.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9870 -7.1820 5.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2180 -8.2390 3.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9930 -5.8280 3.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2240 -5.8960 3.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6110 -10.4300 4.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6290 -12.1870 5.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3390 -12.1620 7.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1840 -8.6040 5.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6070 -8.1140 7.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8920 -7.3880 5.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9630 -9.8020 8.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2430 -9.9170 7.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5390 -11.3980 8.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8650 -6.6760 -0.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0840 -5.8450 -2.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4440 -6.3340 -1.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4710 -5.3970 -3.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3110 -7.0500 1.7080 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 5 6 2 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 2 0 0 0 0 10 29 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 28 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 14 59 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 15 59 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 1 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 19 59 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 22 47 1 0 0 0 0 23 24 2 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 27 1 0 0 0 0 25 26 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 27 54 1 0 0 0 0 28 55 1 0 0 0 0 29 56 1 0 0 0 0 29 57 1 0 0 0 0 29 58 1 0 0 0 0 M END