IBS-ZINC06661813 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 61 0 0 0 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 -0.8100 1.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0370 -2.1210 0.6730 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 -2.1910 -0.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 -0.8690 -1.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.6600 -2.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0230 -1.7230 -3.3620 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0010 -2.9470 -2.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 -3.1900 -1.5740 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0520 0.6200 -3.0870 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0750 0.8180 -4.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1010 2.3160 -4.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1250 2.5190 -6.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3340 2.5950 -7.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3620 2.7810 -8.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1760 2.8920 -9.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0410 2.8150 -8.4150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0610 2.6340 -7.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2070 2.9230 -9.1060 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4180 2.8350 -8.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2020 3.0750 -10.4330 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4870 3.1430 -11.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 -3.2760 1.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3510 -3.6920 1.8950 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0080 -4.6210 1.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3060 -4.9730 1.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8990 -4.3920 2.5400 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2440 -3.5120 3.2720 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0060 -3.1570 2.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0300 -0.3450 2.5090 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 0.0020 -3.7830 -3.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0540 1.3870 -2.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8150 0.3700 -4.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9650 0.3450 -4.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9910 2.7630 -4.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7890 2.7880 -4.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2590 2.5080 -6.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3080 2.8400 -8.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0040 2.5790 -6.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4430 3.6320 -7.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4640 1.8690 -7.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2720 2.9360 -9.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3640 3.2910 -12.1270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0270 2.2140 -10.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0490 3.9780 -10.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5820 -4.1030 1.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5800 -3.0090 2.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5190 -5.0580 0.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8480 -5.6930 0.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9100 -4.6600 2.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5000 -2.4370 3.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9960 -0.2470 2.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5600 -1.0720 3.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5310 0.6210 2.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 2 0 0 0 0 2 6 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 24 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 17 18 2 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 24 51 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 52 1 0 0 0 0 27 28 1 0 0 0 0 27 53 1 0 0 0 0 28 29 2 0 0 0 0 28 54 1 0 0 0 0 29 30 1 0 0 0 0 30 55 1 0 0 0 0 31 56 1 0 0 0 0 31 57 1 0 0 0 0 31 58 1 0 0 0 0 M END