IFLAB-ZINC02722981 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 50 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1870 -0.6740 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1910 -2.0770 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -2.7590 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1700 -2.0990 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2060 -0.7300 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3590 -0.0740 0.0360 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5340 -0.7120 0.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5650 -2.1150 0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3170 -2.8080 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2880 -4.0260 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8630 -2.6270 0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8450 -1.7140 0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1800 -0.0900 0.0770 S 0 0 0 0 0 0 0 0 0 0 0 0 -7.2760 -2.0280 0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6440 -3.1890 0.0960 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.1840 -1.0330 0.1160 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.6150 -1.3480 0.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4230 -0.0480 0.1540 C 0 0 3 0 0 0 0 0 0 0 0 0 -10.1050 0.5700 0.9940 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.9180 -0.3700 0.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.6430 0.8640 0.2860 O 0 0 0 0 0 0 0 0 0 0 0 0 -12.2990 1.7770 -0.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.1700 2.8160 -0.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.8340 3.7510 -1.9170 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6290 3.6550 -2.5870 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7570 2.6210 -2.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0890 1.6780 -1.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.2220 0.6630 -1.0720 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1190 -0.1280 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1280 -2.6130 -0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -3.8380 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0640 -3.6880 0.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8910 -0.1080 0.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8720 -1.9230 -0.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8470 -1.9320 1.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2370 -0.9840 -0.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0980 -0.9040 1.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -14.1120 2.8940 -0.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.5140 4.5590 -2.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.3680 4.3880 -3.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8160 2.5480 -2.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 2 0 0 0 0 2 7 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 4 5 2 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 15 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 2 0 0 0 0 13 14 2 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 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 19 40 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 30 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 43 1 0 0 0 0 26 27 1 0 0 0 0 26 44 1 0 0 0 0 27 28 2 0 0 0 0 27 45 1 0 0 0 0 28 29 1 0 0 0 0 28 46 1 0 0 0 0 29 30 1 0 0 0 0 M END