PUBCHEM-ZINC04257393 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 0 0 0 0 0 0 0 0999 V2000 -0.0180 1.5030 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.7020 1.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0400 -2.0230 1.1890 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -2.6780 0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -1.9800 -1.1530 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0050 -0.6590 -1.1460 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -4.1850 0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4420 -4.6550 0.1370 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7130 -6.0140 0.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6760 -6.9430 0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0020 -8.2970 0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2840 -8.6520 0.1760 N 0 0 0 0 0 0 0 0 0 0 0 0 3.2330 -7.7420 0.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9660 -6.4520 0.2380 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0600 -9.3280 -0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3860 -8.9500 -0.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3740 -9.9110 -0.2970 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0530 -11.2500 -0.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7340 -11.6360 0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2650 -10.6770 0.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4140 -12.9900 0.1510 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0620 -14.0930 -0.9010 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.5430 -15.3410 -0.4630 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4580 -13.8280 -0.8700 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3640 -13.6440 -2.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1680 2.1350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0150 -2.5150 -2.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5180 -4.5610 0.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3800 -4.5490 -0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1680 -4.0150 0.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3520 -6.6210 -0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2610 -8.0640 0.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6410 -7.9040 -0.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4000 -9.6150 -0.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8290 -11.9980 -0.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2920 -10.9750 0.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1880 -13.2850 0.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7230 -13.7120 -2.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7420 -14.3260 -3.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6540 -12.6230 -2.7640 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 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 30 1 0 0 0 0 4 5 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 31 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 19 20 2 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 22 41 1 0 0 0 0 23 24 2 0 0 0 0 23 25 2 0 0 0 0 23 26 1 0 0 0 0 26 42 1 0 0 0 0 26 43 1 0 0 0 0 26 44 1 0 0 0 0 M END