CHEMDIV-ZINC06800393 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 1 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 0.0230 -0.7370 1.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5300 -1.9660 1.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1810 -2.5850 0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0070 -2.1570 -1.1510 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0070 -0.8640 -1.4230 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.6500 -0.0460 -2.3900 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3020 -1.3930 -1.5890 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0700 -3.7380 0.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7450 -4.4180 -0.6700 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5060 -5.4560 -0.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4540 -5.6180 1.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4240 -4.4620 1.8630 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6520 -0.1680 2.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1500 0.9400 2.3600 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6720 -0.8770 3.5440 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2940 -0.3130 4.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1820 -1.3150 5.8950 C 0 0 3 0 0 0 0 0 0 0 0 0 1.6770 -2.2470 5.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8280 -0.7280 7.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6820 -0.7240 8.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2940 -1.7760 7.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2020 -1.5640 6.1920 O 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 -0.4890 -2.5180 2.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6890 -4.1670 -1.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1010 -6.0920 -0.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9890 -6.3820 1.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2740 -1.7610 3.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3460 -0.1060 4.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7870 0.6120 5.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6480 -1.3600 7.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1780 0.2880 6.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0450 -1.0350 9.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2090 0.2560 8.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 -2.7850 7.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3100 -1.5950 7.9700 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 1 0 0 0 0 3 4 2 0 0 0 0 3 15 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 5 6 2 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 2 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 29 1 0 0 0 0 12 13 2 0 0 0 0 12 30 1 0 0 0 0 13 14 1 0 0 0 0 13 31 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 32 1 0 0 0 0 18 19 1 0 0 0 0 18 33 1 0 0 0 0 18 34 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 24 1 0 0 0 0 21 22 1 0 0 0 0 21 35 1 0 0 0 0 21 36 1 0 0 0 0 22 23 1 0 0 0 0 22 37 1 0 0 0 0 22 38 1 0 0 0 0 23 24 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 M END