OTAVA-ZINC00947777 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 37 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 1.2080 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0280 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4110 -0.0140 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 3.9340 -0.8320 -0.0390 S 0 0 0 0 0 0 0 0 0 0 0 0 4.8990 0.0610 0.5000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6790 -2.1210 0.5020 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3470 -1.0640 -1.6260 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6260 0.0260 -2.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6020 1.2780 -2.0770 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8860 2.1420 -2.9500 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1820 1.7290 -4.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0880 -0.0330 -4.1390 S 0 0 0 0 0 0 0 0 0 0 0 0 5.5470 2.5980 -5.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0390 2.8100 -5.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8500 1.9300 -6.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2180 2.1240 -6.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7760 3.1970 -5.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9640 4.0760 -4.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5950 3.8860 -4.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4950 3.4400 -5.4120 Cl 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 1.2230 -1.7590 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.9630 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 3.1650 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3930 -1.9620 -1.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2340 2.1110 -6.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0450 3.5620 -5.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4140 1.0920 -6.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8520 1.4360 -6.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3990 4.9150 -4.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9610 4.5740 -4.1360 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 24 1 0 0 0 0 2 3 2 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 27 1 0 0 0 0 6 28 1 0 0 0 0 7 8 2 0 0 0 0 7 9 2 0 0 0 0 7 10 1 0 0 0 0 10 11 1 0 0 0 0 10 29 1 0 0 0 0 11 12 2 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 30 1 0 0 0 0 16 31 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 32 1 0 0 0 0 19 20 1 0 0 0 0 19 33 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 34 1 0 0 0 0 22 35 1 0 0 0 0 M END