IFLAB-ZINC04284296 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 48 0 0 0 0 0 0 0 0999 V2000 0.2210 1.4370 0.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0870 -0.0080 0.0200 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9730 -0.7320 0.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8330 -0.1730 1.3800 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8980 -2.2100 0.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8160 -2.9610 1.4560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7460 -4.3370 1.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -4.9800 0.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1600 -4.2290 -0.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0940 -2.8530 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6820 -6.4580 0.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4810 -7.1120 1.3300 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2720 -7.0790 -0.0330 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2760 -8.4760 -0.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4820 -9.1610 -0.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4950 -10.5380 -0.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3040 -11.2470 -0.3330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9150 -10.5640 -0.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9220 -9.1720 -0.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1880 -11.3130 -0.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2880 -12.5970 -0.3380 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5190 -13.1350 -0.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8910 -14.4950 -0.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2040 -14.8560 -0.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2020 -13.8970 -0.2960 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8710 -12.5640 -0.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5330 -12.1750 -0.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7840 -10.5820 -0.1490 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.3180 -12.6020 -0.4300 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5520 1.8980 -0.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1120 1.7710 1.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2030 1.7260 -0.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5800 -2.4630 2.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4560 -4.9180 2.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9240 -4.7270 -0.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8070 -2.2720 -0.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9560 -6.5590 -0.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4140 -8.6140 -0.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4350 -11.0650 -0.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8580 -8.6380 -0.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1280 -15.2550 -0.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4710 -15.9000 -0.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2390 -14.1980 -0.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6480 -11.8190 -0.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2920 -12.9310 -1.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 34 1 0 0 0 0 8 9 2 0 0 0 0 8 11 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 17 18 2 0 0 0 0 17 29 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 40 1 0 0 0 0 20 21 2 0 0 0 0 20 28 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 26 2 0 0 0 0 25 43 1 0 0 0 0 26 27 1 0 0 0 0 26 44 1 0 0 0 0 27 28 1 0 0 0 0 29 45 1 0 0 0 0 M END