PUBCHEM-ZINC05853888 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 45 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 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 -1.3720 -0.5110 0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6060 -1.8710 0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8540 -2.3320 0.0170 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0790 -3.6420 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0580 -4.4920 -0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8100 -4.0320 -0.0110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5840 -2.7210 -0.0120 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5450 -5.1590 -0.0290 S 0 0 0 0 0 0 0 0 0 0 0 0 1.9260 -3.9900 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2470 -4.7610 -0.0530 C 0 0 3 0 0 0 0 0 0 0 0 0 3.2940 -5.3840 -0.9460 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3980 -3.7880 -0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2050 -3.8010 0.8400 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3320 -5.6100 1.1390 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8350 -5.3740 1.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1000 -6.7170 1.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7220 -7.0110 0.1260 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1870 -7.5890 2.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3740 -4.1190 0.0220 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6230 -5.5630 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5720 -6.0940 1.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0030 -5.8400 -0.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -0.3650 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1180 0.1090 0.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8640 -3.3590 -0.9230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8800 -3.3670 0.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4080 -8.3510 2.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1640 -8.0710 2.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0520 -6.9780 3.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1200 -3.4980 0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8600 -6.0600 -0.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5880 -5.8970 1.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3340 -5.5960 2.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7570 -7.1680 1.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0400 -5.4610 -1.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1880 -6.9140 -0.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7660 -5.3420 0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5250 -2.9060 -1.0620 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2790 -2.3020 -1.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 6 21 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 16 1 0 0 0 0 14 15 2 0 0 0 0 14 44 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 33 1 0 0 0 0 20 34 1 0 0 0 0 20 35 1 0 0 0 0 21 22 1 0 0 0 0 21 36 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 37 1 0 0 0 0 23 38 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 44 45 1 0 0 0 0 M END