IFLAB-ZINC05153498 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 54 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 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6550 -2.0370 1.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3840 -2.5370 2.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7080 -2.6840 3.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3760 -3.1420 4.8360 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7210 -3.4530 4.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3980 -3.3060 3.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7280 -2.8520 2.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6880 -0.4760 -1.2030 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1880 -0.8750 -2.5520 S 0 0 0 0 0 0 0 0 0 0 0 0 0.7550 -1.2570 -3.5440 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2390 -1.7230 -2.1110 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9510 0.6030 -3.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2820 1.4000 -4.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8800 2.5480 -4.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1600 2.8730 -4.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8180 2.1010 -3.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2100 0.9460 -2.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1350 2.7760 -2.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1520 4.0320 -3.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9150 3.9750 -4.4850 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.4520 4.7420 -5.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9610 5.8150 -5.7430 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2850 4.2350 -6.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2370 3.5200 -5.4580 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 1.7880 -0.2080 1.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2850 -0.0870 2.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3900 -2.3400 1.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1120 -2.4610 0.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3430 -2.4420 3.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8480 -3.2570 5.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2440 -3.8100 5.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4480 -3.5480 3.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2550 -2.7410 1.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6540 -0.5560 -1.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7000 1.1210 -4.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7140 0.3160 -1.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9670 2.1180 -3.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1800 3.0620 -1.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0120 4.0040 -4.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1780 4.9340 -3.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6570 3.5420 -7.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8130 5.0790 -6.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3260 4.2590 -4.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4470 2.9800 -6.1130 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 4 1 0 0 0 0 2 12 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 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 5 35 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 9 10 2 0 0 0 0 9 38 1 0 0 0 0 10 11 1 0 0 0 0 10 39 1 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 13 14 2 0 0 0 0 13 15 2 0 0 0 0 13 16 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 42 1 0 0 0 0 18 19 1 0 0 0 0 18 28 1 0 0 0 0 19 20 2 0 0 0 0 19 24 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 24 25 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 48 1 0 0 0 0 27 49 1 0 0 0 0 28 50 1 0 0 0 0 28 51 1 0 0 0 0 M END