IFLAB-ZINC04061748 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 60 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 -0.4980 -1.2570 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8120 -1.5830 -1.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0770 -0.1030 -2.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8960 -0.9090 -3.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5210 -0.3240 -4.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2110 0.9570 -4.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0740 1.4930 -3.2140 S 0 0 0 0 0 0 0 0 0 0 0 0 2.7740 -0.3450 -2.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1270 0.3660 -2.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9010 0.0770 -1.3910 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1820 0.5290 -0.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8300 -0.1820 -0.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1750 0.6520 -1.4590 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0660 0.4950 -0.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3230 1.0630 -0.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6950 1.7920 -1.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8060 1.9500 -2.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5510 1.3770 -2.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9330 2.3520 -1.6600 O 0 0 0 0 0 0 0 0 0 0 0 0 10.2490 3.0890 -2.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3720 -0.5110 0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0290 -0.6550 1.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4810 -0.3650 2.2240 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4420 -1.1770 1.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1330 -1.3180 2.5490 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6790 -2.5650 1.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0580 -1.9400 -2.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2080 -0.8630 -4.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6010 1.5730 -5.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1870 -0.1090 -3.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9320 -1.4220 -2.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6740 0.0110 -3.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9680 1.4410 -2.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7700 0.2920 0.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0240 1.6060 -0.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9880 -1.2580 -0.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2820 0.1730 0.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7760 -0.0720 0.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0160 0.9410 0.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0960 2.5180 -3.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8600 1.4960 -3.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2630 3.4810 -2.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1780 2.4320 -3.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5480 3.9150 -2.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8100 -0.7430 -0.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0580 -0.8830 0.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5650 -1.0330 3.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2040 -1.1170 2.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4500 -3.1850 1.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8120 -3.1010 2.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0550 0.1070 -1.3280 N 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 4 1 0 0 0 0 2 24 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 57 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 33 1 0 0 0 0 8 9 2 0 0 0 0 8 34 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 11 57 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 15 57 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 44 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 23 50 1 0 0 0 0 24 25 1 0 0 0 0 24 51 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 52 1 0 0 0 0 28 29 1 0 0 0 0 28 53 1 0 0 0 0 28 54 1 0 0 0 0 29 55 1 0 0 0 0 29 56 1 0 0 0 0 M END