CHEMDIV-ZINC05050064 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 45 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2010 -0.6380 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3790 0.1030 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5980 -0.5260 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6770 -1.9350 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4880 -2.6690 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2560 -2.0180 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8920 -4.3840 0.0050 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.6060 -3.9940 0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7760 -2.7180 0.0330 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.6290 -4.9270 0.0300 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.9130 -4.5190 0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1740 -3.3300 0.0530 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.9940 -5.5050 0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.3290 -5.2100 0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.1680 -6.2880 0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5000 -7.5050 0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7730 -7.2510 0.0320 S 0 0 0 0 0 0 0 0 0 0 0 0 -10.2660 -8.7680 0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6900 -10.0010 0.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.4790 -11.1360 0.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.8340 -11.0350 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.4140 -9.8090 -0.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.6400 -8.6610 -0.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.1810 -7.4550 -0.5320 O 0 0 0 0 0 0 0 0 0 0 0 0 -11.6890 -6.2690 0.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3330 1.1820 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5040 0.0620 0.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3420 -2.5930 -0.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4210 -5.8750 0.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6950 -4.1940 0.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6330 -10.0750 0.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.0390 -12.1010 0.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.4440 -11.9260 0.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.4720 -9.7470 -0.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0360 -6.2300 1.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0510 -5.3950 -0.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 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 12 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 17 18 2 0 0 0 0 17 27 1 0 0 0 0 18 19 1 0 0 0 0 18 20 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 38 1 0 0 0 0 24 25 1 0 0 0 0 24 39 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 40 1 0 0 0 0 27 41 1 0 0 0 0 M END