PUBCHEM-ZINC00423539 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 49 0 0 0 0 0 0 0 0999 V2000 0.4630 1.6610 0.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3710 0.1400 0.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9810 -0.5280 1.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8500 -2.0430 1.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2090 -1.8240 -0.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0830 -0.3070 -0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7740 -3.9360 1.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2440 -4.3470 1.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3310 -5.7720 1.7170 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6720 -6.3360 2.5910 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.4460 -7.7580 2.7590 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8790 -5.4900 3.7460 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0150 -6.1480 1.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4290 -7.2980 0.7490 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4900 -7.2270 -0.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1430 -6.0160 -0.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7370 -4.8680 0.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6510 -4.9110 1.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2580 -3.7870 1.9170 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9400 -2.6360 1.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0130 -2.5180 0.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4100 -3.6530 0.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5060 1.9810 0.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0510 2.1360 -0.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0910 2.0370 1.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9430 -0.1750 -0.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0420 -0.2620 1.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4920 -0.1530 2.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3970 -2.4710 0.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2110 -2.4890 2.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2650 -2.1040 -0.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6850 -2.2540 -0.9880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6990 0.0840 0.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4900 0.1150 -1.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2050 -4.2660 2.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3220 -4.3740 0.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6900 -3.7360 2.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7840 -4.1850 0.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9340 -6.4670 1.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9360 -8.2570 0.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8140 -8.1140 -0.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9780 -5.9730 -1.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5850 -1.7850 2.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5300 -1.5730 0.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2540 -3.5870 -0.5080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6090 -2.4250 1.1250 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.1030 -2.0210 1.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 6 1 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 27 1 0 0 0 0 3 28 1 0 0 0 0 4 29 1 0 0 0 0 4 30 1 0 0 0 0 4 46 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 5 32 1 0 0 0 0 5 46 1 0 0 0 0 6 33 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 7 46 1 0 0 0 0 8 9 1 0 0 0 0 8 37 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 39 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 2 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 15 16 2 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 16 42 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 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 22 45 1 0 0 0 0 46 47 1 0 0 0 0 M CHG 1 46 1 M END