OTAVA-ZINC05236461 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 38 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3760 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 1.2220 -0.6850 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4170 0.0360 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3860 1.4200 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 2.0880 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5480 2.1250 -0.0200 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2460 -2.1600 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1340 -2.8270 -0.0140 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1570 -4.2280 -0.0210 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2620 -5.0380 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8390 -6.2710 -0.0370 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4460 -6.2980 -0.0250 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9200 -5.0730 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6190 -4.6070 0.0180 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.3940 -6.2430 0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8920 -6.0890 0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5970 -6.0120 -1.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9720 -5.8710 -1.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6430 -5.8060 0.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9370 -5.8820 1.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5630 -6.0290 1.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3690 -5.6270 0.1120 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9010 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 3.3640 -0.4840 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1470 3.1670 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8760 2.3340 -0.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1900 -2.6840 -0.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2920 -4.7140 -0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0980 -6.7870 -0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0720 -6.7950 0.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0740 -6.0630 -2.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5220 -5.8110 -2.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4600 -5.8310 2.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0120 -6.0930 2.1790 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 8 1 0 0 0 0 4 5 2 0 0 0 0 4 26 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 27 1 0 0 0 0 7 28 1 0 0 0 0 8 9 2 0 0 0 0 8 29 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 11 12 2 0 0 0 0 11 30 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 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 31 1 0 0 0 0 16 32 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 33 1 0 0 0 0 19 20 1 0 0 0 0 19 34 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 35 1 0 0 0 0 22 36 1 0 0 0 0 M END