OTAVA-ZINC05318436 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 51 0 0 0 0 0 0 0 0999 V2000 1.2720 1.2220 -0.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6310 -0.1390 -0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6420 -0.8340 1.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 -2.0870 1.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5490 -2.6420 0.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5560 -1.9400 -1.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 -0.6880 -1.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0120 0.1940 -2.6970 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.1280 -3.8710 0.1340 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7250 -4.3770 -1.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0630 -2.7940 2.4000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1670 -2.1290 3.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1510 -0.9160 3.5790 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3040 -2.8920 4.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3990 -1.9490 5.9770 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7290 -1.5310 6.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6910 -0.6950 7.6000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4770 -0.1960 8.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6700 -0.5810 7.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6070 -1.5050 6.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6240 -1.8800 5.8200 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8350 0.0410 8.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5380 0.8600 9.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8060 0.9290 9.3700 S 0 0 0 0 0 0 0 0 0 0 0 0 3.5670 1.6320 9.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9460 1.0150 9.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1720 0.8750 8.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2580 -0.2240 7.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3190 1.1140 -0.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7540 1.8220 -0.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2060 1.7150 0.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1100 -0.4020 1.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0220 -2.3680 -2.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9680 -4.4550 -1.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1490 -5.3620 -0.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5150 -3.7000 -1.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 -3.7620 2.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5680 -3.5320 4.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2040 -3.5070 4.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6860 -1.9030 6.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5720 2.6750 9.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3190 1.5720 10.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7140 1.6610 10.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9930 0.0320 10.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9400 1.8200 7.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2130 0.6110 7.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5920 -1.1930 7.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2880 -0.2180 6.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 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 32 1 0 0 0 0 4 5 1 0 0 0 0 4 11 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 9 10 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 37 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 38 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 20 1 0 0 0 0 16 17 2 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 24 1 0 0 0 0 19 20 1 0 0 0 0 19 22 1 0 0 0 0 20 21 2 0 0 0 0 22 23 2 0 0 0 0 22 28 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 26 27 1 0 0 0 0 26 43 1 0 0 0 0 26 44 1 0 0 0 0 27 28 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 28 47 1 0 0 0 0 28 48 1 0 0 0 0 M END