IFLAB-ZINC01792767 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 1 0 0 0 0 0999 V2000 -0.0260 1.6200 0.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1090 0.2300 0.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0380 -0.5440 0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2880 0.0580 -0.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3500 1.4620 -0.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2030 2.2360 -0.0430 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4970 -0.7580 -0.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3230 -0.5700 -1.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4690 -1.3500 -1.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8180 -2.3330 -0.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0080 -2.5310 0.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8600 -1.7520 0.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9600 -3.0200 -1.0780 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3750 -4.0220 -0.1610 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6590 -4.6900 -0.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2630 -4.3440 -1.6530 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0640 -5.7080 0.1940 N 0 0 0 0 0 0 0 0 0 0 0 0 10.2330 -6.5750 -0.0320 C 0 0 3 0 0 0 0 0 0 0 0 0 11.0130 -5.9910 -0.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8710 -7.8470 -0.8160 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6330 -7.6100 -2.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4090 -7.5570 -2.9130 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6260 -7.3080 -4.2410 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9020 -7.2010 -4.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9740 -7.2220 -4.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6340 -7.4060 -3.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0440 -7.3580 -3.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7380 -7.1260 -4.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0500 -6.9450 -5.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6530 -6.9890 -5.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7680 -7.1330 1.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9180 -7.1020 2.2570 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9190 2.2230 0.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0670 -0.2530 0.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9490 -1.6280 0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3010 1.9650 -0.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2710 3.3210 -0.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0750 0.1800 -2.2680 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0950 -1.1910 -2.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2380 -3.2800 1.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2500 -1.9200 1.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5820 -3.5790 0.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6080 -4.8020 -0.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5830 -5.9220 1.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6680 -8.5990 -0.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9760 -8.3120 -0.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4040 -7.6600 -2.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5870 -7.4930 -2.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8240 -7.0830 -4.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6070 -6.7620 -6.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1190 -6.8420 -6.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9640 -7.5380 1.3060 O 0 5 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 33 1 0 0 0 0 2 3 2 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 35 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 36 1 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 39 1 0 0 0 0 10 11 2 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 31 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 21 22 2 0 0 0 0 21 26 1 0 0 0 0 22 23 1 0 0 0 0 22 47 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 30 2 0 0 0 0 26 27 2 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 28 29 2 0 0 0 0 28 49 1 0 0 0 0 29 30 1 0 0 0 0 29 50 1 0 0 0 0 30 51 1 0 0 0 0 31 32 2 0 0 0 0 31 52 1 0 0 0 0 M CHG 1 52 -1 M END