PUBCHEM-ZINC02972704 MOE2007 3D CORINA 3.40 0006 02.08.2006 63 66 0 0 1 0 0 0 0 0999 V2000 0.3950 0.0980 -1.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2480 -1.3580 -1.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2750 -1.7490 0.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1400 -3.0850 0.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0230 -4.0330 -0.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0500 -3.6470 -1.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0790 -2.3070 -2.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0470 -1.9240 -3.4470 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1300 -2.9540 -4.4220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1760 -3.5800 2.2010 S 0 0 0 0 0 0 0 0 0 0 0 0 0.5690 -4.9460 2.2110 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8800 -2.5640 2.9020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3830 -3.5390 2.7580 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3840 -4.4540 2.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6110 -4.4820 3.1160 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.3360 -4.9060 4.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6880 -5.3260 2.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0550 -5.1230 1.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0500 -5.9230 0.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6390 -6.8910 1.4160 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2640 -7.0560 2.6700 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.3170 -6.3170 3.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2470 -3.0930 4.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6860 -1.6460 4.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0510 -1.0340 3.1860 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9140 -1.0540 2.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4750 -2.5020 2.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5260 0.2670 3.3670 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9260 1.0210 2.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3950 2.3070 2.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4680 2.8440 3.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0710 2.0950 4.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6060 0.8070 4.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4500 0.3320 -1.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1500 0.3010 -2.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0090 0.7130 -0.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4020 -1.0110 0.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1280 -5.0760 -0.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1770 -4.3880 -2.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0760 -3.4650 -4.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1380 -2.5140 -5.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6900 -3.6690 -4.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6340 -2.9080 3.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6770 -4.1130 1.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 -5.4560 2.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5770 -4.3580 0.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3620 -5.7920 -0.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4160 -7.5180 1.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0340 -6.4850 4.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9480 -3.5400 5.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0760 -3.6610 3.8140 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5480 -1.6300 5.1390 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8670 -1.0850 4.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2130 -0.6080 1.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0860 -0.4870 2.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2950 -3.0630 1.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6140 -2.5180 1.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8690 0.6030 1.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7060 2.8940 1.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8360 3.8490 3.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1290 2.5170 5.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3000 0.2210 5.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1100 -3.1140 3.3070 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 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 37 1 0 0 0 0 4 5 1 0 0 0 0 4 10 1 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 8 9 1 0 0 0 0 9 40 1 0 0 0 0 9 41 1 0 0 0 0 9 42 1 0 0 0 0 10 11 2 0 0 0 0 10 12 2 0 0 0 0 10 13 1 0 0 0 0 13 14 1 0 0 0 0 13 43 1 0 0 0 0 14 15 1 0 0 0 0 14 44 1 0 0 0 0 14 45 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 63 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 19 47 1 0 0 0 0 20 21 2 0 0 0 0 20 48 1 0 0 0 0 21 22 1 0 0 0 0 22 49 1 0 0 0 0 23 24 1 0 0 0 0 23 50 1 0 0 0 0 23 51 1 0 0 0 0 23 63 1 0 0 0 0 24 25 1 0 0 0 0 24 52 1 0 0 0 0 24 53 1 0 0 0 0 25 26 1 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 54 1 0 0 0 0 26 55 1 0 0 0 0 27 56 1 0 0 0 0 27 57 1 0 0 0 0 27 63 1 0 0 0 0 28 29 1 0 0 0 0 28 33 2 0 0 0 0 29 30 2 0 0 0 0 29 58 1 0 0 0 0 30 31 1 0 0 0 0 30 59 1 0 0 0 0 31 32 2 0 0 0 0 31 60 1 0 0 0 0 32 33 1 0 0 0 0 32 61 1 0 0 0 0 33 62 1 0 0 0 0 M END