PUBCHEM-ZINC03875980 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 0 0 0 0 0 0 0 0 0 0 -1.3390 -0.4990 0.0120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4980 -1.8450 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3760 -2.6760 -0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4900 -4.0290 -0.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7540 -4.6470 -0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8810 -6.0460 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1210 -6.6100 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2680 -5.8200 0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1800 -4.4590 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9220 -3.8470 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7820 -2.3910 0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9680 -1.5230 0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4740 -1.1570 -1.0010 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4950 -1.1310 1.2210 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0920 -1.4230 2.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6770 -0.2660 1.2430 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.2860 -0.3560 0.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4800 -0.3530 2.5430 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.5600 -0.4480 2.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9770 1.0020 2.8560 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.3760 1.1660 1.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8220 2.0930 1.0830 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1030 1.0750 4.0300 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.0640 1.0000 3.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4220 -0.0800 5.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7500 -1.4610 3.8050 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.2210 -0.3950 5.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6680 0.2260 5.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3160 2.3940 4.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3160 3.0370 4.5120 O 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 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6080 -2.2310 -0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4020 -4.6390 -0.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0010 -6.6710 -0.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2160 -7.6850 -0.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2390 -6.2910 0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0770 -3.8570 0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9580 0.4900 6.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4780 -1.2090 6.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3740 -0.6910 5.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5230 0.3630 5.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8630 -0.6030 6.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5040 1.1370 6.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3940 2.8550 5.5880 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5750 3.7060 6.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 36 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 13 2 0 0 0 0 5 6 2 0 0 0 0 5 38 1 0 0 0 0 6 7 1 0 0 0 0 6 39 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 9 41 1 0 0 0 0 10 11 2 0 0 0 0 10 42 1 0 0 0 0 11 12 1 0 0 0 0 11 43 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 23 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 28 1 0 0 0 0 22 23 1 0 0 0 0 22 25 1 0 0 0 0 23 24 2 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 31 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 30 1 0 0 0 0 29 44 1 0 0 0 0 29 45 1 0 0 0 0 29 46 1 0 0 0 0 30 47 1 0 0 0 0 30 48 1 0 0 0 0 30 49 1 0 0 0 0 31 32 2 0 0 0 0 31 50 1 0 0 0 0 50 51 1 0 0 0 0 M END