IFLAB-ZINC02709872 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 40 0 0 1 0 0 0 0 0999 V2000 -0.2260 1.3430 -0.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0920 -0.1830 -0.0930 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4320 -0.5490 1.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3110 -2.0310 1.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1960 -2.7160 2.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0590 -4.0920 2.5410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 -4.7880 1.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8620 -4.1090 1.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7230 -2.7300 0.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7010 -2.0220 0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7360 -2.5690 -0.3160 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4180 -0.7280 -0.2710 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8620 -0.6620 -1.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9980 -1.0620 -0.9690 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3110 -0.5420 -2.4810 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8750 -0.8630 -3.7390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1380 -1.4460 -3.8850 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6390 -1.7420 -5.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8840 -1.4580 -6.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6240 -0.8750 -6.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1010 -0.5690 -4.8880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2650 0.0760 -4.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6730 0.2960 -3.5770 O 0 5 0 0 0 0 0 0 0 0 0 0 0.7470 1.8380 -0.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6730 1.6500 -1.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8890 1.7270 0.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4710 -0.2220 1.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1720 -0.0630 2.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0010 -2.1860 2.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7550 -4.6210 3.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0740 -5.8590 2.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6670 -4.6580 0.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6620 -0.1560 -2.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7540 -1.6860 -3.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6210 -2.1950 -5.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2730 -1.6880 -7.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -0.6530 -7.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8900 0.3510 -5.8400 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 12 1 0 0 0 0 2 13 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 2 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 32 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 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 33 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 35 1 0 0 0 0 19 20 2 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 38 2 0 0 0 0 M CHG 1 23 -1 M END