IFLAB-ZINC02961267 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 53 0 0 0 0 0 0 0 0999 V2000 0.2200 1.5580 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2530 0.0280 -0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8060 -0.4990 1.3170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8400 -2.0290 1.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3570 -2.5210 2.5200 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4530 -3.8680 2.6550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9480 -4.4140 3.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0470 -5.7800 3.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6490 -6.6180 2.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1520 -6.0660 1.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0510 -4.6990 1.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7540 -8.0830 3.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1880 -8.5620 4.1070 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3700 -8.8900 2.0680 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5710 -10.2680 2.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6600 -11.1440 1.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8550 -12.5040 1.6720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9710 -13.0040 2.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8850 -12.1230 2.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6860 -10.7630 2.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1830 -14.4630 2.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1790 -15.0230 3.0480 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2340 -16.3650 3.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2040 -17.2140 3.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0500 -18.5770 3.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9570 -19.0860 2.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0620 -18.2850 2.2960 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1600 -16.9620 2.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1120 -15.6820 1.7720 S 0 0 0 0 0 0 0 0 0 0 0 0 1.2290 1.9400 0.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1750 1.9340 -0.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4200 1.8890 0.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7570 -0.3540 -0.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8920 -0.3030 -0.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8160 -0.1170 1.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1670 -0.1680 2.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1700 -2.4110 1.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4790 -2.3600 0.4640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2550 -3.7650 4.6410 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4320 -6.2020 4.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8440 -6.7110 0.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6630 -4.2720 0.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9540 -8.5140 1.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2030 -10.7570 1.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1460 -13.1840 1.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7480 -12.5060 3.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3950 -10.0800 3.2750 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0510 -16.8010 4.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7790 -19.2460 3.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8380 -20.1550 2.7360 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 2 33 1 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 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 8 40 1 0 0 0 0 9 10 2 0 0 0 0 9 12 1 0 0 0 0 10 11 1 0 0 0 0 10 41 1 0 0 0 0 11 42 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 43 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 18 19 2 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 46 1 0 0 0 0 20 47 1 0 0 0 0 21 22 2 0 0 0 0 21 29 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 26 27 2 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 M END