PUBCHEM-ZINC06269037 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 45 0 0 0 0 0 0 0 0999 V2000 -0.0130 1.1990 -0.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1600 -0.1770 -0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4390 -0.7320 0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5470 0.1410 0.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3520 1.5320 -0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0810 2.0740 -0.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7790 3.4460 -0.4360 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5680 4.5730 -0.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2150 4.7970 -0.5970 S 0 0 0 0 0 0 0 0 0 0 0 0 3.9540 -0.3560 0.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3790 -1.1650 -0.6250 O 0 5 0 0 0 0 0 0 0 0 0 0 1.5890 -2.2380 0.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0620 -3.0600 -0.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7070 -3.0280 -2.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 -3.7610 -3.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0580 -4.5280 -2.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5880 -4.5780 -1.7470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0800 -3.8510 -0.6670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7650 -3.9650 0.5200 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1820 -3.4680 1.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9540 -2.6520 1.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4890 -2.2080 2.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8880 -2.5630 4.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2510 -3.3630 4.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7900 -3.8170 2.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8710 -3.7280 5.2310 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4670 -5.2550 -4.0090 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0260 1.5710 -0.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7220 -0.8160 -0.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2410 2.1500 -0.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2170 3.6390 -0.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9120 5.4590 -0.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6420 -2.5240 0.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6060 -2.4240 -2.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7250 -3.7170 -4.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4790 -5.1850 -1.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 -1.5750 2.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3200 -2.2050 5.0130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6760 -4.4440 2.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3810 -3.3400 5.9740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0950 -5.1170 -4.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5840 0.0720 1.2690 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 28 1 0 0 0 0 2 3 2 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 12 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 8 9 2 0 0 0 0 8 32 1 0 0 0 0 10 11 1 0 0 0 0 10 42 2 0 0 0 0 12 13 1 0 0 0 0 12 21 1 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 16 17 2 0 0 0 0 16 27 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 22 37 1 0 0 0 0 23 24 2 0 0 0 0 23 38 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 25 39 1 0 0 0 0 26 40 1 0 0 0 0 27 41 1 0 0 0 0 M CHG 1 11 -1 M END