PUBCHEM-ZINC05956041 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 0 0 0 0 0 0999 V2000 0.0240 1.3160 -0.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0340 -0.1960 -0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4560 -0.7170 -0.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0420 -1.1390 -1.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3500 -1.6470 -1.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0860 -1.7010 -0.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5420 -1.2560 1.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2330 -0.7720 1.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6150 -0.2420 2.6350 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -5.7850 -2.3010 -0.1350 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.4690 -1.3540 0.7430 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.1490 -2.2090 -1.5470 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3270 -1.1100 -2.5080 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7300 -0.1610 -3.2180 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2090 -0.2620 -4.5300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0630 -0.5820 -5.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4450 -0.8340 -5.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2540 -1.1490 -6.5610 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7030 -1.2200 -7.8340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3430 -0.9750 -8.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5150 -0.6540 -6.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1490 -0.4000 -7.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6800 -0.0660 -6.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1480 0.0050 -4.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 0.3520 -3.7680 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0650 1.6540 -0.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4410 1.6320 -1.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4910 1.8330 0.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5530 -0.6770 -0.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4730 -0.4880 0.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7910 -1.9970 -2.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1380 -1.2930 1.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9100 -0.7850 -4.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3140 -1.3400 -6.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3290 -1.4650 -8.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9320 -1.0350 -9.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2810 -0.4530 -8.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7330 0.1380 -6.2230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4810 0.2880 -2.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6320 -3.6530 0.3930 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 13 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 10 11 2 0 0 0 0 10 12 2 0 0 0 0 10 40 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 24 2 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 33 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 19 20 2 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 22 37 1 0 0 0 0 23 24 1 0 0 0 0 23 38 1 0 0 0 0 24 25 1 0 0 0 0 25 39 1 0 0 0 0 M CHG 1 40 -1 M END