PUBCHEM-ZINC02855634 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 0 0 0 0 0 0999 V2000 -0.5880 1.3780 1.7380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4820 0.0800 1.0950 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6250 -0.4750 0.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6810 0.1090 0.7880 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5940 -1.7900 -0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3730 -2.4200 -0.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3500 -3.6490 -0.8950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5340 -4.2680 -1.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7470 -3.6590 -1.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7900 -2.4220 -0.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0130 -1.8090 -0.1340 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.0890 -2.5570 0.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9710 -3.7580 0.3370 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.4090 -1.9210 0.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5510 -0.5420 0.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7870 0.0470 0.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8940 -0.7210 0.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7720 -2.0840 0.8120 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5340 -2.6970 0.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4080 -4.0690 0.8350 N 0 0 0 0 0 0 0 0 0 0 0 0 -8.3170 -4.8440 1.9820 S 0 0 0 0 0 0 0 0 0 0 0 0 -9.6690 -4.4890 1.7300 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.8590 -6.1890 2.0150 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.9000 -4.1390 3.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8360 -3.4550 4.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5270 -2.8890 5.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2780 -3.0050 6.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2870 -3.7040 5.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6000 -4.2850 4.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6610 -4.9560 3.3830 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4480 -5.0960 3.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0770 -4.5560 5.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9840 -3.8480 5.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4010 1.7100 2.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0080 2.0980 1.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2380 1.2990 2.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5530 -1.9420 0.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5940 -4.1340 -1.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5060 -5.2320 -1.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6650 -4.1470 -1.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0920 -0.8440 -0.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6910 0.0610 -0.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8940 1.1120 0.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8590 -0.2500 0.7460 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6390 -2.6750 1.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7890 -4.5730 0.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8340 -3.3480 3.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2890 -2.3510 6.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0510 -2.5610 6.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7180 -5.6460 3.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0690 -4.6880 5.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7130 -3.4200 6.7780 H 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 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 8 9 2 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 40 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 41 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 17 18 2 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 21 22 2 0 0 0 0 21 23 2 0 0 0 0 21 24 1 0 0 0 0 24 25 2 0 0 0 0 24 29 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 26 27 2 0 0 0 0 26 48 1 0 0 0 0 27 28 1 0 0 0 0 27 49 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 30 31 1 0 0 0 0 31 32 2 0 0 0 0 31 50 1 0 0 0 0 32 33 1 0 0 0 0 32 51 1 0 0 0 0 33 52 1 0 0 0 0 M END