OTAVA-ZINC05237617 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 44 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3790 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 1.2050 -0.6800 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4030 0.0330 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4270 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1690 2.0920 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6980 -0.6880 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9860 -1.6710 0.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5940 -2.3080 0.5270 S 0 0 0 0 0 0 0 0 0 0 0 0 5.8780 -1.1900 -0.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7600 -0.3820 -0.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8010 0.5900 -2.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8480 1.3230 -2.2280 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9100 0.6850 -2.7880 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9520 1.3420 -3.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9730 -0.1390 -2.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9540 -1.0320 -1.5980 N 0 0 0 0 0 0 0 0 0 0 0 0 8.4100 0.0080 -3.5670 S 0 0 0 0 0 0 0 0 0 0 0 0 9.4440 -1.2820 -2.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7640 -1.3410 -3.5570 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8240 -0.5650 -3.1210 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0350 -0.6140 -3.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1910 -1.4500 -4.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1170 -2.2300 -5.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9130 -2.1740 -4.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4850 -1.5070 -5.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4170 -0.8270 -5.2170 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 1.9040 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5560 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 -1.7600 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3020 1.9850 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 3.1720 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3160 -2.0300 1.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6160 -1.0540 -1.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9400 -2.2450 -2.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7020 0.0810 -2.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8620 -0.0080 -3.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2310 -2.8770 -6.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0830 -2.7800 -4.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6320 -2.3140 -6.6660 O 0 0 0 0 0 0 0 0 0 0 0 0 15.4970 -2.3180 -7.0980 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 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 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 31 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 17 1 0 0 0 0 11 12 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 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 34 1 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 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 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 38 1 0 0 0 0 25 39 1 0 0 0 0 26 27 2 0 0 0 0 26 40 1 0 0 0 0 40 41 1 0 0 0 0 M END