IBS-ZINC00541030 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 49 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 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 -1.4120 -0.5260 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8530 -1.3230 -1.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1470 -1.7950 -1.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9840 -1.4540 0.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3830 -1.8380 0.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8950 -1.3180 1.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2310 -1.6120 1.8130 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9480 -2.3730 0.9970 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.4250 -2.8500 -0.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1880 -2.6010 -0.4710 N 0 0 0 0 0 0 0 0 0 0 0 0 -7.7860 -1.1150 2.9820 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.1760 -1.4280 3.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5380 -0.7610 4.6520 C 0 0 3 0 0 0 0 0 0 0 0 0 -8.8230 -1.0650 5.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9460 -1.1880 5.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.4960 0.6590 4.4990 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6880 -0.3600 2.3120 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.4700 -0.6500 1.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2040 -0.2230 1.0140 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4100 -2.6350 -2.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0120 -2.9830 -2.7970 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1480 -1.8120 -2.2790 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 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -1.6010 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0370 -3.4660 -0.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2550 -0.5600 3.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8360 -1.0560 2.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2940 -2.5080 3.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.6600 -0.8840 4.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9770 -2.2720 5.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2030 -0.7140 6.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7150 1.1480 5.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9470 -3.5440 -1.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9780 -2.0650 -2.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6600 -3.9330 -2.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0220 -3.0040 -3.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1010 -1.0180 -3.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1460 -2.1620 -2.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 29 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 22 2 0 0 0 0 5 6 2 0 0 0 0 5 25 1 0 0 0 0 6 7 1 0 0 0 0 6 23 1 0 0 0 0 7 8 1 0 0 0 0 7 21 2 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 20 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 18 37 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 19 40 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 M END