OTAVA-ZINC05236872 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 39 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 1.1960 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 0.0150 -2.8180 -2.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3320 -3.0730 -2.9160 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5120 -3.7430 -4.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4120 -4.1460 -4.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5870 -4.8280 -6.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8580 -5.1130 -6.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9720 -4.7120 -5.7340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7920 -4.0280 -4.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3300 -5.0140 -6.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4950 -5.6580 -7.3400 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.6840 -5.9220 -7.7620 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.8510 -6.5720 -8.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1170 -6.8540 -9.3480 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4490 -7.0790 -9.8370 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 0.0550 -3.8480 -0.0190 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 0.5130 -2.2170 -3.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5440 -3.7630 -2.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5850 -3.9250 -4.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2730 -5.1380 -6.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9910 -5.6450 -7.4070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6480 -3.7180 -3.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1890 -4.7040 -5.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8890 -6.5750 -8.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2400 -7.3320 -10.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0950 -7.7090 -10.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 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 25 1 0 0 0 0 4 5 1 0 0 0 0 4 26 1 0 0 0 0 5 6 2 0 0 0 0 5 27 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 28 1 0 0 0 0 8 9 1 0 0 0 0 8 29 1 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 13 14 2 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 34 1 0 0 0 0 16 17 2 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 36 1 0 0 0 0 20 37 1 0 0 0 0 21 38 1 0 0 0 0 M END