IFLAB-ZINC02958302 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 45 0 0 0 0 0 0 0 0999 V2000 -1.8820 0.9640 1.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3810 -0.4230 1.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2270 -0.7580 1.9280 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3470 -1.9670 1.6890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1890 -2.8130 0.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3960 -4.0420 0.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5150 -4.4320 1.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0560 -3.5950 2.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4780 -2.3570 2.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0270 -1.5060 3.3680 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5820 -2.0200 4.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6790 -3.2230 4.6140 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0780 -1.1100 5.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9810 0.0930 5.4280 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6330 -1.6240 6.6740 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1190 -0.7310 7.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6900 -1.5510 8.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9370 -1.7820 9.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4590 -2.5340 11.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7360 -3.0570 10.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4930 -2.8280 9.7980 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9680 -2.0780 8.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7090 -1.8560 7.6370 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0170 -2.4300 7.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0990 1.7010 1.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7620 1.2200 0.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1430 0.9600 2.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1640 -1.1590 1.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1200 -0.4190 0.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0630 -2.5110 0.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0240 -4.7000 -0.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9680 -5.3940 1.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9310 -3.9020 2.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0080 -0.5450 3.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7110 -2.5850 6.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8940 -0.0800 7.3240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2930 -0.1250 8.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9400 -1.3750 10.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8700 -2.7140 11.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1420 -3.6440 11.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4900 -3.2360 9.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9410 -3.5140 7.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4980 -2.1770 6.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6090 -2.0360 8.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 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 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 38 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 20 21 2 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 M END