IFLAB-ZINC01123135 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 40 0 0 0 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 0.0230 -0.7020 1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0840 1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7680 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0710 -1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6890 -1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 -4.5300 -0.0230 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6020 -4.9170 -1.2800 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6270 -4.9300 1.2190 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5100 -5.0430 -0.0090 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3150 -4.7770 -1.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8850 -4.1620 -2.0110 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7470 -5.2440 -1.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5600 -4.7360 -2.5810 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.1720 -5.3920 -2.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1580 -5.2960 -3.1310 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.3340 -5.8510 -2.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5480 -5.8830 -3.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6520 -6.5020 -2.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5940 -7.1070 -1.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4200 -7.0890 -1.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2890 -6.4650 -1.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6630 -6.2780 -0.8680 S 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 0.0250 -0.1670 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6290 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.6060 -2.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1440 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8540 -5.5350 0.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7750 -6.3300 -0.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2670 -4.8000 -0.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6080 -5.4160 -4.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5760 -6.5180 -3.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4690 -7.5920 -1.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.3760 -7.5610 -0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 31 1 0 0 0 0 8 9 2 0 0 0 0 8 10 2 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 24 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 21 22 2 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 22 38 1 0 0 0 0 23 24 1 0 0 0 0 M END