IBS-ZINC05347921 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 52 0 0 0 0 0 0 0 0999 V2000 1.2810 1.7250 1.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7240 0.3920 1.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4780 -0.1000 0.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7650 -0.8590 0.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0410 -1.9060 1.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7860 -2.5230 2.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1660 -3.9000 1.8760 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8550 -4.6650 2.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2270 -5.9840 2.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0670 -6.8790 1.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6750 -8.0680 1.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1680 -7.9460 2.9700 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9240 -6.7240 3.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2040 -6.1390 4.6380 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8360 -4.8980 4.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1850 -4.1650 3.9890 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7680 -9.2680 0.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3640 -10.4460 1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2190 -11.3140 0.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5500 -10.6380 -0.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2740 -9.4040 -0.3640 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4000 -6.5750 0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0010 -6.5120 -1.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9930 -6.1950 -2.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8400 -6.0820 -1.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0880 -6.3170 -0.0900 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9540 1.5650 2.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1170 2.4240 1.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4570 2.1340 1.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0510 0.5520 0.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5480 -0.0180 1.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1950 -0.2920 -0.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6410 0.9690 0.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6300 -1.9170 0.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9970 -0.7420 1.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5840 -0.4600 0.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7060 -1.8580 0.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1740 -2.5200 0.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6830 -1.9390 2.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1390 -2.5230 3.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9350 -4.2760 1.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0820 -4.4580 5.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8530 -10.6680 2.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5760 -12.3310 0.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2780 -11.0240 -1.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0480 -6.6720 -1.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1210 -6.0680 -3.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1250 -5.8460 -1.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5980 -0.5510 1.3700 N 0 0 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 30 1 0 0 0 0 2 31 1 0 0 0 0 2 49 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 3 49 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 5 38 1 0 0 0 0 5 49 1 0 0 0 0 6 7 1 0 0 0 0 6 39 1 0 0 0 0 6 40 1 0 0 0 0 7 8 1 0 0 0 0 7 41 1 0 0 0 0 8 9 1 0 0 0 0 8 16 2 0 0 0 0 9 10 1 0 0 0 0 9 13 2 0 0 0 0 10 11 2 0 0 0 0 10 22 1 0 0 0 0 11 12 1 0 0 0 0 11 17 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 42 1 0 0 0 0 17 18 2 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 18 43 1 0 0 0 0 19 20 2 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 22 23 2 0 0 0 0 22 26 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 24 25 2 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 M END