IBS-ZINC06645550 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.3780 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0280 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4110 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7110 -0.7070 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1430 -0.9500 -1.4840 C 0 0 3 0 0 0 0 0 0 0 0 0 4.1690 -0.0010 -2.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5140 -1.5750 -1.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6760 -2.6610 -2.0060 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1870 -1.8500 -2.1340 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0410 -1.8240 -3.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7000 -1.0550 -4.1410 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0580 -2.7500 -4.1430 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0550 -2.5510 -3.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4380 -4.2020 -3.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4220 -5.1430 -4.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4450 -4.9410 -6.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2240 -3.5180 -6.3030 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0880 -2.5210 -5.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0220 -3.0470 -7.3410 S 0 0 0 0 0 0 0 0 0 0 0 0 0.3970 -1.7680 -7.8340 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2390 -4.1600 -8.1850 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4320 -2.8010 -6.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6980 -1.5600 -5.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8400 -1.3670 -5.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7150 -2.4160 -4.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4490 -3.6580 -5.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3100 -3.8490 -6.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9050 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2230 -1.7590 -0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3050 1.9630 -0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 3.1650 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4680 -0.1100 0.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5990 -1.6640 0.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6600 -2.4650 -1.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4310 -4.4070 -4.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4410 -4.3610 -2.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6800 -6.1760 -4.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4250 -4.9210 -4.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4140 -5.2480 -6.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6560 -5.5360 -6.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7220 -1.5190 -5.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1090 -2.6310 -6.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0150 -0.7400 -5.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0470 -0.3970 -4.6480 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6060 -2.2660 -4.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1330 -4.4780 -5.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1050 -4.8180 -6.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5550 -0.9250 -0.9580 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4150 -1.3660 -0.9930 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 31 1 0 0 0 0 2 3 2 0 0 0 0 2 32 1 0 0 0 0 3 4 1 0 0 0 0 3 33 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 35 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 7 37 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 12 1 0 0 0 0 10 11 2 0 0 0 0 10 52 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 21 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 19 44 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 22 23 2 0 0 0 0 22 24 2 0 0 0 0 22 25 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 28 29 2 0 0 0 0 28 49 1 0 0 0 0 29 30 1 0 0 0 0 29 50 1 0 0 0 0 30 51 1 0 0 0 0 52 53 1 0 0 0 0 M END