IFLAB-ZINC04033969 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 49 0 0 0 0 0 0 0 0999 V2000 -1.7010 1.3590 1.2710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3620 -0.1080 1.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2810 -0.7580 2.2150 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1510 -0.6910 0.0090 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9570 -2.0360 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3450 -2.5460 0.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5710 -3.8860 0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5160 -4.7770 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3180 -6.1680 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3930 -7.0020 -0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6910 -6.4970 -0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9210 -5.1550 -0.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8360 -4.2630 -0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0360 -2.8730 -0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4320 -2.3080 -0.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8500 -2.1100 -1.5110 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1410 -1.5790 -1.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0140 -1.0540 -1.3120 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1440 -1.8020 -3.2990 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.2800 -1.9660 -4.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1530 -1.0810 -5.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1220 -1.5330 -6.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7200 -1.0670 -6.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2120 -1.7060 -4.8280 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8010 -1.9840 -3.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1340 -2.3730 -2.5660 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8360 1.6510 2.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8900 1.9410 0.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6220 1.5470 0.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1820 -1.8640 0.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5820 -4.2660 0.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6820 -6.5740 0.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2380 -8.0700 -0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5270 -7.1800 -0.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9330 -4.7780 -0.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1190 -3.0000 0.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3290 -3.0050 -4.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1980 -1.7150 -3.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1200 -1.0380 -5.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8950 -0.0760 -5.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1270 -2.6220 -6.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3980 -1.1560 -7.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0600 -1.3270 -6.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7240 0.0150 -5.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1700 -1.9900 -4.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4520 -1.3500 0.4420 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 14 2 0 0 0 0 6 7 2 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 32 1 0 0 0 0 10 11 1 0 0 0 0 10 33 1 0 0 0 0 11 12 2 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 36 1 0 0 0 0 15 46 1 0 0 0 0 16 17 1 0 0 0 0 16 26 2 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 25 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 24 25 2 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 M END