PUBCHEM-ZINC05573012 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 58 0 0 1 0 0 0 0 0999 V2000 1.4130 1.8970 3.5030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0100 0.7210 2.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2030 0.6840 1.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1320 -0.0010 0.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4420 -1.3410 1.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7440 -2.3100 2.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4210 -3.8470 2.0650 S 0 3 0 0 0 0 0 0 0 0 0 0 3.0100 -4.1350 3.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7450 -4.4260 1.7000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5440 -4.4810 0.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0980 -5.3850 1.3920 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8050 -5.4840 0.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5640 -6.5550 2.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8270 -7.5360 1.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3350 -8.6090 2.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5820 -8.7050 3.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3250 -7.7150 4.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8170 -6.6480 3.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0560 -9.8570 4.3920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3030 -9.9520 5.7600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8110 -11.0260 6.4740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0740 -12.0060 5.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1740 -11.9170 4.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3080 -10.8440 3.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6020 -5.3580 1.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2720 -5.2590 0.4900 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7690 1.5190 4.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2160 2.4910 3.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8270 2.5190 2.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6530 1.0990 1.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5960 0.0990 3.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8010 0.7260 0.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 1.6960 1.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6850 -0.1390 1.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7150 0.6200 0.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9480 -0.9710 0.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3550 -1.1470 1.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6950 -1.7820 0.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4710 -1.8580 3.4130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8260 -2.5250 3.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6040 -5.4210 2.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0210 -3.7390 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7990 -3.5160 -0.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1860 -5.2530 -0.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4980 -4.7150 -0.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6360 -7.4600 0.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7600 -9.3740 1.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5200 -7.7840 5.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3970 -5.8820 4.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8790 -9.1880 6.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0020 -11.1010 7.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3090 -12.8450 6.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7490 -12.6850 3.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1090 -10.7720 2.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9260 -0.0800 2.1410 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1970 -5.4440 2.6910 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1630 -5.4220 2.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 2 55 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 3 55 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 5 38 1 0 0 0 0 5 55 1 0 0 0 0 6 7 1 0 0 0 0 6 39 1 0 0 0 0 6 40 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 11 1 0 0 0 0 9 10 1 0 0 0 0 9 41 1 0 0 0 0 9 42 1 0 0 0 0 10 43 1 0 0 0 0 10 44 1 0 0 0 0 10 45 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 25 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 46 1 0 0 0 0 15 16 1 0 0 0 0 15 47 1 0 0 0 0 16 17 2 0 0 0 0 16 19 1 0 0 0 0 17 18 1 0 0 0 0 17 48 1 0 0 0 0 18 49 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 50 1 0 0 0 0 21 22 1 0 0 0 0 21 51 1 0 0 0 0 22 23 2 0 0 0 0 22 52 1 0 0 0 0 23 24 1 0 0 0 0 23 53 1 0 0 0 0 24 54 1 0 0 0 0 25 26 2 0 0 0 0 25 56 1 0 0 0 0 56 57 1 0 0 0 0 M CHG 1 7 1 M END