PUBCHEM-ZINC04878267 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 46 0 0 1 0 0 0 0 0999 V2000 -0.0240 1.4780 0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0010 0.0130 0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0210 -0.7850 1.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0380 -2.0630 0.7380 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0290 -2.1800 -0.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 -0.8030 -1.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0340 -0.3260 -2.7550 S 0 0 0 0 0 0 0 0 0 0 0 0 1.6950 -0.2120 -3.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1750 0.1640 -4.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5770 0.2360 -4.5350 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3740 -0.0480 -3.5220 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8790 -0.3950 -2.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5860 -0.4740 -2.1150 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7600 0.6170 -5.8430 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5280 0.7620 -6.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6030 0.4940 -5.5140 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0450 0.8280 -6.5140 C 0 0 3 0 0 0 0 0 0 0 0 0 5.7340 1.3580 -5.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6520 -0.5230 -6.9520 C 0 0 3 0 0 0 0 0 0 0 0 0 6.7400 -0.4910 -6.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1960 -0.6810 -8.4200 C 0 0 3 0 0 0 0 0 0 0 0 0 4.5770 -1.5710 -8.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3680 0.5930 -8.6950 C 0 0 3 0 0 0 0 0 0 0 0 0 3.3080 0.4000 -8.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8560 1.5660 -7.7420 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6030 1.0830 -10.1260 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7420 2.1910 -10.3980 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3270 -0.7450 -9.2920 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1380 -1.5870 -6.1480 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0430 -3.4420 -1.3530 N 0 3 0 0 0 0 0 0 0 0 0 0 0.0660 -4.6020 -0.7300 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 -3.4020 -2.6690 O 0 5 0 0 0 0 0 0 0 0 0 0 0.9980 1.8580 -0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5510 1.8340 -0.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5360 1.8320 0.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0240 -0.4300 2.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5630 -0.6200 -1.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3400 1.0560 -7.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6410 1.3940 -10.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3880 0.2760 -10.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8370 2.5530 -11.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0980 -0.8440 -10.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4860 -2.4590 -6.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 6 1 0 0 0 0 3 4 2 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 5 6 2 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 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 16 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 14 15 1 0 0 0 0 14 17 1 0 0 0 0 15 16 2 0 0 0 0 15 38 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 25 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 29 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 28 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 26 1 0 0 0 0 26 27 1 0 0 0 0 26 39 1 0 0 0 0 26 40 1 0 0 0 0 27 41 1 0 0 0 0 28 42 1 0 0 0 0 29 43 1 0 0 0 0 30 31 2 0 0 0 0 30 32 1 0 0 0 0 M CHG 1 30 1 M CHG 1 32 -1 M END