IFLAB-ZINC04275684 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 36 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4480 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6210 -0.6140 1.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1310 0.0510 1.9160 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6800 -2.0760 1.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1020 -2.9410 0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2760 -4.2290 0.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 -4.4510 1.8420 S 0 0 0 0 0 0 0 0 0 0 0 0 1.2940 -2.7720 2.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9320 -2.1890 3.1860 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5060 -2.9650 4.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4640 -4.1730 4.0250 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1990 -2.3320 5.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7600 -3.4260 6.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4530 -2.7920 7.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7440 -2.5180 8.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3800 -1.9370 9.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7260 -1.6310 9.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4360 -1.9060 8.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8010 -2.4910 7.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8250 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8090 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7990 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4190 -2.5740 -0.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0800 -5.0330 -0.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9650 -1.2230 3.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0140 -1.7000 4.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4860 -1.7250 5.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9450 -4.0570 6.5700 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4730 -4.0330 5.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6920 -2.7580 8.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8250 -1.7230 10.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2220 -1.1760 10.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4870 -1.6660 8.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3560 -2.7090 6.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 9 2 0 0 0 0 6 7 2 0 0 0 0 6 24 1 0 0 0 0 7 8 1 0 0 0 0 7 25 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 26 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 27 1 0 0 0 0 13 28 1 0 0 0 0 14 15 1 0 0 0 0 14 29 1 0 0 0 0 14 30 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 31 1 0 0 0 0 17 18 1 0 0 0 0 17 32 1 0 0 0 0 18 19 2 0 0 0 0 18 33 1 0 0 0 0 19 20 1 0 0 0 0 19 34 1 0 0 0 0 20 35 1 0 0 0 0 M END