IFLAB-ZINC04138761 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 0 0 0 0 0 0 0 0999 V2000 -0.0620 1.5020 0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0300 -0.0050 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6040 -0.7140 1.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5760 -2.0940 1.0400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 -2.7710 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6030 -2.0560 -1.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5680 -0.6750 -1.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2600 -2.7860 -2.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -4.1700 -0.0210 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1810 -4.8480 1.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1840 -4.2510 2.1930 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3160 -6.3490 1.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4610 -6.9610 2.8180 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6010 -8.6900 2.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7390 -9.6040 3.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8470 -10.9750 3.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8130 -11.3550 1.9940 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6820 -10.4620 1.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5720 -9.1700 1.2640 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6490 -10.9420 -0.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9830 -11.8720 4.3010 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0130 -11.4450 5.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1340 -12.2690 6.4610 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9140 -10.1490 5.9130 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7770 -9.1900 4.9700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6880 -8.0170 5.2800 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9550 -9.7690 7.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0970 -13.3040 4.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8260 1.8810 0.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0800 1.8720 -1.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9540 1.8430 0.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0740 -0.1870 1.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0240 -2.6470 1.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0120 -0.1190 -1.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5230 -2.9780 -2.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0680 -2.1760 -2.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6650 -3.7330 -1.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0090 -4.6510 -0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5650 -6.7880 0.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2060 -6.6280 0.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3810 -11.1500 -0.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0610 -10.1720 -1.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2420 -11.8520 -0.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0680 -10.6620 7.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7990 -9.1010 7.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 -9.2600 7.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1470 -13.5670 3.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6760 -13.8760 4.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5520 -13.5340 3.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 34 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 9 10 1 0 0 0 0 9 38 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 25 1 0 0 0 0 16 17 1 0 0 0 0 16 21 1 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 41 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 28 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 27 1 0 0 0 0 25 26 2 0 0 0 0 27 44 1 0 0 0 0 27 45 1 0 0 0 0 27 46 1 0 0 0 0 28 47 1 0 0 0 0 28 48 1 0 0 0 0 28 49 1 0 0 0 0 M END