IFLAB-ZINC01196123 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 61 0 0 0 0 0 0 0 0999 V2000 -0.0250 1.4230 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 0.1840 -0.6280 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2540 -0.5100 -0.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3780 0.0320 -0.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2960 1.2860 0.5900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0820 1.9760 0.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4860 1.8730 1.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4970 3.0390 1.9570 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7370 3.6180 2.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7920 3.2370 2.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4140 4.2220 3.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7630 4.1260 3.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5020 3.0530 2.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9080 2.0740 2.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5410 2.1500 1.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6890 1.3520 1.2200 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5840 -0.6670 -0.0410 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5840 -2.0120 0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5320 -2.6210 0.0460 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8640 -2.7470 0.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8670 -4.1400 0.2280 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0640 -4.8190 0.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2600 -4.1230 0.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2640 -2.7420 0.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0740 -2.0510 0.1320 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7850 -4.9990 0.4270 S 0 0 0 0 0 0 0 0 0 0 0 0 9.7370 -4.0820 0.9490 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4880 -6.2450 1.0420 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2670 -5.3440 -1.1200 N 0 0 0 0 0 0 0 0 0 0 0 0 10.1170 -4.4060 -1.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3510 -5.1560 -2.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9040 -6.3770 -3.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1020 -7.3200 -2.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8580 -6.5960 -1.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9620 1.9600 -0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8130 -0.2410 -1.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3120 -1.4750 -1.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0110 2.9420 1.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8440 5.0600 3.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2480 4.8920 4.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5580 2.9910 3.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4930 1.2440 1.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4240 -0.1860 -0.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9340 -4.6840 0.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0680 -5.8970 0.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2010 -2.2050 0.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0780 -0.9740 0.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5600 -4.0020 -2.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4280 -3.5930 -1.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9420 -4.4970 -3.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9540 -5.4820 -1.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2800 -6.0530 -4.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7800 -6.9000 -3.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8040 -8.2010 -2.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7170 -7.6250 -1.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3400 -7.2290 -1.0490 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1970 -6.3750 -2.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 35 1 0 0 0 0 2 3 2 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 4 5 2 0 0 0 0 4 17 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 7 16 2 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 13 14 2 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 23 24 2 0 0 0 0 23 26 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 25 47 1 0 0 0 0 26 27 2 0 0 0 0 26 28 2 0 0 0 0 26 29 1 0 0 0 0 29 30 1 0 0 0 0 29 34 1 0 0 0 0 30 31 1 0 0 0 0 30 48 1 0 0 0 0 30 49 1 0 0 0 0 31 32 1 0 0 0 0 31 50 1 0 0 0 0 31 51 1 0 0 0 0 32 33 1 0 0 0 0 32 52 1 0 0 0 0 32 53 1 0 0 0 0 33 34 1 0 0 0 0 33 54 1 0 0 0 0 33 55 1 0 0 0 0 34 56 1 0 0 0 0 34 57 1 0 0 0 0 M END