IFLAB-ZINC04275673 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 30 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 1.9310 -2.1900 3.1850 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5050 -2.9660 4.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4640 -4.1760 4.0240 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1850 -2.3450 5.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7810 -3.1460 6.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4140 -2.5610 7.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4600 -1.1830 7.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8710 -0.3810 6.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2390 -0.9550 5.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9200 0.9640 6.6060 F 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 1.9640 -1.2240 3.2670 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7450 -4.2220 6.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8740 -3.1810 8.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9580 -0.7310 8.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7850 -0.3300 4.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 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 23 1 0 0 0 0 7 8 1 0 0 0 0 7 24 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 25 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 26 1 0 0 0 0 15 16 1 0 0 0 0 15 27 1 0 0 0 0 16 17 2 0 0 0 0 16 28 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 29 1 0 0 0 0 M END