PUBCHEM-ZINC00633553 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 49 0 0 1 0 0 0 0 0999 V2000 0.0300 1.6850 0.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 0.2630 -0.0160 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1880 -0.3550 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3470 0.4000 0.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5820 -0.2090 0.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6790 -1.5910 0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5100 -2.3560 -0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2630 -1.7260 -0.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9480 -3.7490 -0.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2870 -3.7490 -0.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7420 -2.4690 0.0680 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.3330 -2.0380 0.2280 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.9890 -3.1430 0.8330 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3400 -0.7300 0.7840 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.0000 -1.8910 -1.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6930 -2.9470 -1.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2160 -2.8320 -3.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0460 -1.6610 -3.9450 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3540 -0.6040 -3.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8340 -0.7180 -2.1080 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1590 -4.9760 -0.1480 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.2070 -4.6780 -0.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8540 -5.7530 -1.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6780 -5.6460 -2.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3580 -6.3790 -3.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2360 -7.1860 -3.6310 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4750 -7.2630 -2.5570 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.7450 -6.5760 -1.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9020 -5.7960 0.9940 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0560 2.0500 0.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 2.1320 -0.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4160 1.9590 1.0800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2780 1.4730 0.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4740 0.3850 0.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3640 -2.3100 -0.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3140 -4.6140 -0.3230 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8260 -3.8630 -1.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7580 -3.6580 -3.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4540 -1.5710 -4.9410 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2210 0.3110 -3.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2960 0.1090 -1.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5490 -5.0080 -2.4950 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9780 -6.3200 -4.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9800 -7.7600 -4.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0950 -6.6610 -0.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9710 -6.0350 1.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 33 1 0 0 0 0 5 6 1 0 0 0 0 5 34 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 35 1 0 0 0 0 9 10 2 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 21 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 2 0 0 0 0 12 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 37 1 0 0 0 0 17 18 1 0 0 0 0 17 38 1 0 0 0 0 18 19 2 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 29 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 26 27 2 0 0 0 0 26 44 1 0 0 0 0 27 28 1 0 0 0 0 28 45 1 0 0 0 0 29 46 1 0 0 0 0 M END