IBS-ZINC06645565 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 49 0 0 0 0 0 0 0 0999 V2000 0.2970 2.3000 0.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 0.8190 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6340 0.0000 1.0550 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1210 -0.3900 2.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2990 -1.1360 3.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7010 -1.5780 3.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1630 -2.2480 4.0980 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5490 -1.1790 2.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9940 -0.3880 0.9850 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8490 -0.0280 -0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1660 -0.4500 -0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6710 -1.2130 0.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8900 -1.5970 2.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9840 -1.5160 0.7940 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2510 -0.8510 -0.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1010 -0.1750 -1.0050 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6480 -1.3940 4.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9820 -0.4500 4.9910 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1600 -2.6850 4.4130 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1190 -2.9580 5.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7030 -4.1650 6.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4540 -5.3970 5.4410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4270 -5.0530 4.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8570 -3.8280 3.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0110 -6.6430 6.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0760 -6.5560 7.4920 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3670 2.5300 0.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1760 2.8960 -0.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1140 2.6210 1.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0490 0.6600 -0.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3830 0.5100 -1.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1440 -0.0190 2.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5240 0.5780 -0.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3030 -2.1990 2.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0480 -0.1140 -0.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6000 -1.5950 -1.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2410 -2.0880 6.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0890 -3.1430 5.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7920 -3.9190 6.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4860 -4.3760 7.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4010 -5.6700 4.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5490 -4.8600 4.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2880 -5.8970 3.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7740 -4.0520 2.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0900 -3.5870 2.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6680 -7.6350 5.5270 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 9 1 0 0 0 0 4 5 2 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 17 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 11 12 2 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 25 1 0 0 0 0 22 41 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 24 44 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 M CHG 1 46 -1 M END