PUBCHEM-ZINC00745706 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 1 0 0 0 0 0999 V2000 2.3900 0.9930 0.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9920 -0.4530 0.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9430 -1.2710 1.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5790 -2.5960 1.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2590 -3.1090 0.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3100 -2.2780 -0.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6710 -0.9540 -0.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8680 -4.5280 0.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9280 -5.2760 1.2120 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4460 -4.9910 -0.9380 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0980 -6.3370 -1.1090 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7080 -7.0260 -1.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1490 -6.3300 -2.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2980 -5.2180 -3.4520 S 0 0 0 0 0 0 0 0 0 0 0 0 0.4920 -4.1790 -2.1620 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.0670 -3.2530 -2.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9210 -3.8790 -2.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3870 -2.7400 -3.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7200 -2.8750 -3.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0830 -4.0300 -2.7710 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9970 -4.6400 -2.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7560 -6.7800 0.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2160 -5.9550 0.9340 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8340 -8.0910 0.4720 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4740 -8.5220 1.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4290 -10.0480 1.8130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0870 -10.4910 3.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4420 -10.7600 3.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0460 -11.1660 4.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2940 -11.3030 5.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9380 -11.0350 5.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3340 -10.6330 4.2450 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4710 1.0850 0.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8950 1.5870 0.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0930 1.3530 1.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1910 -0.8730 2.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5410 -3.2340 2.5290 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0640 -2.6690 -1.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7070 -0.3090 -1.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2890 -7.3280 -2.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0960 -5.9050 -1.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7890 -1.9180 -3.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3850 -2.1750 -3.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9880 -5.5830 -1.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4660 -8.7500 -0.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9440 -8.0890 2.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5110 -8.1880 1.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9580 -10.4810 0.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3910 -10.3820 1.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0300 -10.6530 2.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1050 -11.3760 4.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7660 -11.6200 6.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3510 -11.1410 6.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2740 -10.4260 4.2260 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 7 39 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 22 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 21 2 0 0 0 0 18 19 2 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 21 44 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 50 1 0 0 0 0 29 30 1 0 0 0 0 29 51 1 0 0 0 0 30 31 2 0 0 0 0 30 52 1 0 0 0 0 31 32 1 0 0 0 0 31 53 1 0 0 0 0 32 54 1 0 0 0 0 M END