IFLAB-ZINC02698937 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 0 0 0 0 0 0999 V2000 0.1000 1.1120 -0.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0660 -0.4060 -0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3650 -0.8770 -0.0610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9860 -1.2420 -1.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2780 -1.6720 -1.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0010 -1.7520 -0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3660 -1.3810 1.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0330 -0.9470 1.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0960 -1.4620 2.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4080 -1.9050 2.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9580 -2.2510 1.0640 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3720 -2.0300 3.7600 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.1850 -0.8120 4.4670 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.6490 -2.5100 3.3620 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6510 -3.2960 4.7510 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7750 -2.9630 5.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2090 -3.9560 6.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5200 -5.2820 6.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3960 -5.6150 5.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9660 -4.6210 4.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9020 -6.3650 7.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5180 -1.1090 3.5630 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1280 0.3060 3.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6290 0.6950 4.9610 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.1840 5.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8530 -1.6560 5.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3740 -1.9770 3.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1360 1.4540 -0.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3820 1.3730 -1.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4280 1.5930 0.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5950 -0.8860 -0.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5480 -0.6660 0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4350 -1.1820 -2.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7450 -1.9520 -2.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5400 -0.6650 2.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9810 -2.5960 1.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5320 -1.9280 5.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5240 -3.6970 7.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6390 -6.6500 5.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6540 -4.8810 3.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5400 -6.5600 8.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8020 -7.2750 6.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9180 -6.0430 7.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3320 0.4660 2.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9880 0.9210 3.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3250 1.7420 4.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4290 0.5490 5.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6190 -0.0100 4.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1020 0.0600 6.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9940 -2.2890 5.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6400 -1.8390 6.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6880 -3.0200 3.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5820 -1.8070 3.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2710 -2.1710 -0.0520 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 31 1 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 54 2 0 0 0 0 7 8 1 0 0 0 0 7 9 2 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 22 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 11 36 1 0 0 0 0 11 54 1 0 0 0 0 12 13 2 0 0 0 0 12 14 2 0 0 0 0 12 15 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 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 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 39 1 0 0 0 0 20 40 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 27 1 0 0 0 0 23 24 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 26 51 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 M END