PUBCHEM-ZINC05818821 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 1 0 0 0 0 0999 V2000 0.1240 1.2000 0.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2290 -0.1670 0.6890 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5260 -0.8190 0.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5360 -0.4670 0.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1640 0.7520 0.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2790 1.7850 0.4270 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6220 0.8830 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1440 -0.4880 -0.4820 C 0 0 3 0 0 0 0 0 0 0 0 0 3.6430 -0.6920 -1.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6250 -1.5870 0.4290 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1660 -1.8100 0.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4100 -2.2740 1.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6080 -1.5480 2.2910 S 0 0 0 0 0 0 0 0 0 0 0 0 4.0490 -3.6100 1.4690 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4930 -4.5920 2.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4770 -6.0000 1.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8660 -7.0640 2.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9840 -6.9950 4.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9860 -5.5980 4.7290 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6000 -4.5320 3.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6320 -0.5200 -0.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2630 0.5690 -0.7730 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8160 1.7070 0.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7910 1.6550 -0.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1380 1.1930 0.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8200 -2.4480 1.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9430 -2.2870 -0.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4150 -3.9420 0.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5240 -4.3610 2.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4780 -6.2250 1.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1650 -6.0430 0.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7850 -8.0580 2.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9150 -6.9270 3.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9580 -7.2750 3.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3330 -7.7230 4.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2900 -5.5660 5.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9830 -5.3750 5.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6630 -3.5420 4.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5490 -4.6690 3.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0330 -1.6210 -1.3790 O 0 5 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 23 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 4 5 2 0 0 0 0 4 11 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 24 1 0 0 0 0 7 25 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 21 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 11 26 1 0 0 0 0 11 27 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 28 1 0 0 0 0 15 16 1 0 0 0 0 15 20 1 0 0 0 0 15 29 1 0 0 0 0 16 17 1 0 0 0 0 16 30 1 0 0 0 0 16 31 1 0 0 0 0 17 18 1 0 0 0 0 17 32 1 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 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 20 38 1 0 0 0 0 20 39 1 0 0 0 0 21 22 2 0 0 0 0 21 40 1 0 0 0 0 M CHG 1 40 -1 M END