IFLAB-ZINC04275815 MOE2007 3D CORINA 3.40 0006 02.08.2006 34 35 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.4610 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1560 -0.6940 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2180 -0.1000 0.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1360 -2.1600 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0800 -2.9440 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1430 -4.2500 -0.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8640 -4.5900 -0.0040 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.2680 -2.9340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5610 -2.4380 0.0340 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6080 -3.2870 0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4170 -4.4880 0.0360 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9850 -2.7600 0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2090 -1.3800 0.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4980 -0.8940 0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5740 -1.7660 0.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3670 -3.1310 0.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0770 -3.6380 0.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8720 -4.9790 0.0560 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.0320 -5.8130 0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8380 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5450 1.8220 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.8120 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8490 -0.4780 -0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0680 -2.5080 -0.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6310 -5.0040 -0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7130 -1.4800 0.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3730 -0.6960 0.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6700 0.1720 0.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5810 -1.3760 0.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2120 -3.8050 0.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6380 -5.5990 -0.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7280 -6.8600 0.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6160 -5.6160 0.9620 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 2 24 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 25 1 0 0 0 0 7 8 1 0 0 0 0 7 26 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 27 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 18 2 0 0 0 0 14 15 2 0 0 0 0 14 28 1 0 0 0 0 15 16 1 0 0 0 0 15 29 1 0 0 0 0 16 17 2 0 0 0 0 16 30 1 0 0 0 0 17 18 1 0 0 0 0 17 31 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 32 1 0 0 0 0 20 33 1 0 0 0 0 20 34 1 0 0 0 0 M END