PUBCHEM-ZINC04822960 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 48 0 0 1 0 0 0 0 0999 V2000 -0.0350 1.4600 0.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0070 -0.0690 0.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5380 -0.5270 1.8030 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2750 -0.3070 2.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6220 -0.9710 2.6880 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5380 -2.0520 2.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1740 -0.2750 1.4130 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0690 0.7950 1.5950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3220 -0.5740 0.3350 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6500 -0.5390 1.2950 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.8040 -1.4840 0.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3150 -0.6150 2.6910 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.8330 -1.5670 2.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9020 -0.4850 3.9040 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.2490 0.4990 2.8720 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.5980 0.4610 2.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1160 1.6270 2.9320 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.1360 2.4860 3.3010 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9260 1.7710 3.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8000 2.3940 3.6040 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8130 3.6620 3.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9240 4.3740 4.0010 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0980 3.8390 3.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2570 4.5930 3.7300 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2570 0.5150 0.5450 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5030 0.1720 -0.9170 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.8670 1.4110 -1.5110 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3270 -0.5160 -1.3190 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9210 -0.9590 -0.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9180 -0.5360 -0.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9740 1.8510 0.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4400 1.8190 -0.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6680 1.8010 1.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 -0.7620 3.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4120 0.7620 3.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1540 -0.4100 2.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8800 4.1380 4.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1090 4.1880 3.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2180 5.5260 3.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7500 -0.4870 -0.3540 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2270 -1.1890 -1.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6400 -1.8790 -0.3720 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9230 -0.1420 -0.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9540 -1.6250 -0.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5280 -0.1730 -1.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 9 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 4 35 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 14 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 25 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 15 16 1 0 0 0 0 15 19 1 0 0 0 0 16 17 2 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 37 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 38 1 0 0 0 0 24 39 1 0 0 0 0 25 26 1 0 0 0 0 26 27 2 0 0 0 0 26 28 2 0 0 0 0 26 29 1 0 0 0 0 29 40 1 0 0 0 0 29 41 1 0 0 0 0 29 42 1 0 0 0 0 30 43 1 0 0 0 0 30 44 1 0 0 0 0 30 45 1 0 0 0 0 M END