IFLAB-ZINC04341557 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 47 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3780 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 1.2110 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3990 0.0310 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3780 1.4120 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1490 3.5930 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1550 4.0740 1.3940 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1380 5.3980 1.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1180 6.1900 0.7290 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1440 5.8930 3.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1180 7.7020 3.0790 S 0 0 0 0 0 0 0 0 0 0 0 0 1.1300 8.0000 4.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1150 9.3140 5.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0920 10.6010 4.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0870 11.4860 5.7030 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1080 10.8370 6.9440 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1250 9.4900 6.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 8.4120 7.5040 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1620 7.2040 6.9830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1470 6.9890 5.6800 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1100 11.4620 8.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7840 12.6640 8.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7850 13.2790 9.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1150 12.6980 10.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4420 11.5000 10.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4340 10.8850 9.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1170 13.3010 11.8830 F 0 0 0 0 0 0 0 0 0 0 0 0 1.2300 -2.0300 -0.0200 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3430 -0.4950 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.9670 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0290 3.9710 -0.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2490 3.9460 -0.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 3.4400 2.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2640 5.5140 3.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0440 5.5400 3.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0790 10.8170 3.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1800 6.3540 7.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3080 13.1160 7.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 14.2130 9.7480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0800 11.0490 11.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0940 9.9520 9.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 30 1 0 0 0 0 2 3 2 0 0 0 0 2 31 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 36 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 21 2 0 0 0 0 14 15 1 0 0 0 0 14 18 2 0 0 0 0 15 16 2 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 43 1 0 0 0 0 27 44 1 0 0 0 0 M END