IBS-ZINC05204005 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 46 0 0 0 0 0 0 0 0999 V2000 -0.9340 1.0060 0.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6460 -0.3640 -0.1180 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4980 -0.5010 -0.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7500 -1.9990 -1.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6600 -4.1070 -1.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0800 -4.6010 -1.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6080 -5.1270 -2.3110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9420 -5.5430 -2.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7710 -5.4290 -1.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2500 -4.9040 -0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9120 -4.4900 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1300 -4.8230 0.9970 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6280 -4.3960 2.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0890 -5.8070 -1.2170 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7250 -6.1730 -2.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2010 -6.3460 -2.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9210 -5.4470 -1.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2900 -5.6210 -1.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8920 -6.6900 -1.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2470 -7.5730 -2.6430 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.9170 -7.3780 -2.7950 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.5750 -6.9790 -1.6850 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.0930 1.4800 0.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1550 1.5360 -0.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8140 1.0530 0.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2700 -0.0540 -1.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3730 -0.0060 -0.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3880 -2.2500 -1.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1660 -2.4060 -0.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2260 -4.3020 -0.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0330 -4.5970 -1.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9900 -5.2260 -3.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3010 -5.9580 -3.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4990 -4.0750 0.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4490 -4.4450 2.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8320 -5.0580 2.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2880 -3.3560 2.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5970 -5.3890 -3.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2950 -7.1150 -2.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4150 -4.6150 -0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.8580 -4.9380 -0.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4310 -8.1040 -3.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5890 -2.6440 -1.3170 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.2120 -2.1390 -0.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9660 -2.4240 -2.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 4 28 1 0 0 0 0 4 29 1 0 0 0 0 4 43 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 5 31 1 0 0 0 0 5 43 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 10 2 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 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 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 21 42 1 0 0 0 0 43 44 1 0 0 0 0 43 45 1 0 0 0 0 M CHG 1 43 1 M END