IFLAB-ZINC04850769 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 1 0 0 0 0 0999 V2000 0.3430 1.4630 -0.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3640 -0.0360 -0.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2010 -0.7890 0.8950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2460 -2.1840 0.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4640 -2.8550 -0.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6530 -2.0940 -1.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6070 -0.6980 -1.4800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4910 -4.3790 -0.3880 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2630 -4.7600 0.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9000 -4.8830 -0.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9790 -4.3800 0.0170 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1060 -4.7730 1.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3120 -5.5430 1.8660 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1960 -4.1640 2.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9220 -3.9680 3.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8690 -3.3830 4.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1020 -2.9930 3.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3910 -3.1960 2.4720 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4450 -3.7840 1.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9310 -4.0340 -0.0180 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -2.0070 -4.4720 -0.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1000 -5.0400 -1.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7740 -7.0050 -2.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6290 -6.4910 -1.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1540 -7.0300 -2.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3530 1.8450 -0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0340 1.8820 -1.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3150 1.8170 0.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -0.2920 1.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1140 -2.7400 1.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8420 -2.5670 -2.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7630 -0.1270 -2.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9570 -5.9740 -0.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1290 -4.5940 -1.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6520 -3.7320 -0.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9610 -4.2660 3.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6460 -3.2340 5.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8440 -2.5390 4.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3660 -2.8990 2.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0150 -3.3810 -0.9170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1510 -4.7800 0.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0690 -4.6860 -1.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9710 -4.6360 -2.7790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5790 -6.7140 -3.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7640 -8.1010 -2.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7190 -6.8530 -0.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3200 -6.8150 -1.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0430 -6.7100 -3.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1330 -6.6940 -2.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1670 -8.1250 -2.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6230 -4.9660 -1.2860 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.4690 -4.6220 -2.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0850 -6.5090 -1.7840 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 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 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 51 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 12 13 2 0 0 0 0 12 14 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 36 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 17 18 2 0 0 0 0 17 38 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 21 51 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 22 53 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 23 53 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 24 51 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 25 53 1 0 0 0 0 51 52 1 0 0 0 0 M CHG 1 51 1 M END