IFLAB-ZINC02722330 MOE2007 3D CORINA 3.40 0006 02.08.2006 60 63 0 0 0 0 0 0 0 0999 V2000 0.2310 1.7820 -1.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2760 0.3000 -2.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7150 -0.4640 -1.1540 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8100 -1.8100 -1.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2300 -2.6110 -0.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3270 -3.9780 -0.4390 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 -4.5510 -1.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5830 -3.7480 -2.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4820 -2.3820 -2.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1020 -5.9380 -1.8340 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6790 -6.7700 -0.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1080 -6.1380 0.5220 S 0 0 0 0 0 0 0 0 0 0 0 0 0.8750 -8.0980 -0.9780 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4150 -9.0020 0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0180 -9.4460 -0.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4920 -10.3760 0.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1200 -10.0250 2.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3960 -11.1390 2.7470 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8460 -11.1380 3.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9400 -12.2630 2.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3590 -11.8350 0.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8110 -12.7700 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8460 -14.1000 0.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4210 -14.5270 1.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 -13.6200 2.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4690 -8.6130 2.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5490 -8.6380 -2.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0340 -8.6950 -1.9130 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6100 -9.8280 -1.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9800 -9.8360 -1.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7210 -8.7220 -1.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1400 -7.6620 -2.0180 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8400 -7.6210 -2.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4620 1.9260 -1.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2260 2.1120 -1.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1040 2.3650 -2.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7200 -0.0300 -2.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9680 0.1560 -3.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4820 -2.1660 0.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6540 -4.6020 0.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3320 -4.1930 -3.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1510 -1.7580 -3.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4750 -6.3000 -2.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0660 -9.8750 0.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4440 -8.4840 1.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6690 -8.5720 -0.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0470 -9.9640 -1.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3620 -12.4450 -0.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4220 -14.8230 -0.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4400 -15.5810 1.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4070 -13.9630 3.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4600 -8.3650 2.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4640 -8.5270 3.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7360 -7.9260 1.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1760 -9.6410 -2.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3490 -7.9940 -3.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0050 -10.6840 -1.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4620 -10.7010 -0.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7890 -8.7200 -1.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4000 -6.7370 -2.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 37 1 0 0 0 0 2 38 1 0 0 0 0 3 4 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 39 1 0 0 0 0 6 7 1 0 0 0 0 6 40 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 41 1 0 0 0 0 9 42 1 0 0 0 0 10 11 1 0 0 0 0 10 43 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 27 1 0 0 0 0 14 15 1 0 0 0 0 14 44 1 0 0 0 0 14 45 1 0 0 0 0 15 16 1 0 0 0 0 15 46 1 0 0 0 0 15 47 1 0 0 0 0 16 17 2 0 0 0 0 16 21 1 0 0 0 0 17 18 1 0 0 0 0 17 26 1 0 0 0 0 18 19 1 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 22 23 1 0 0 0 0 22 48 1 0 0 0 0 23 24 2 0 0 0 0 23 49 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 25 51 1 0 0 0 0 26 52 1 0 0 0 0 26 53 1 0 0 0 0 26 54 1 0 0 0 0 27 28 1 0 0 0 0 27 55 1 0 0 0 0 27 56 1 0 0 0 0 28 29 1 0 0 0 0 28 33 2 0 0 0 0 29 30 2 0 0 0 0 29 57 1 0 0 0 0 30 31 1 0 0 0 0 30 58 1 0 0 0 0 31 32 2 0 0 0 0 31 59 1 0 0 0 0 32 33 1 0 0 0 0 33 60 1 0 0 0 0 M END