PUBCHEM-ZINC05162499 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 46 0 0 1 0 0 0 0 0999 V2000 -0.3770 0.5260 -0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0910 -0.7820 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4670 -1.0300 0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4030 0.0190 0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9070 1.3270 -0.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5310 1.5800 -0.0800 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7660 -0.3000 0.0530 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9480 0.4500 0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9150 1.8030 -0.0040 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0700 2.5140 -0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2810 1.8110 0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1940 0.4320 0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0710 -0.3010 0.0830 N 0 0 0 0 0 0 0 0 0 0 0 0 8.4940 -0.0030 0.1030 N 0 0 0 0 0 0 0 0 0 0 0 0 9.2950 1.1110 0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5960 2.2270 0.0130 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9400 -1.3810 0.1380 C 0 0 3 0 0 0 0 0 0 0 0 0 8.1190 -1.9870 -0.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3640 -1.9880 1.5060 C 0 0 3 0 0 0 0 0 0 0 0 0 8.4820 -2.4970 1.9210 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3510 -3.0630 1.0100 C 0 0 3 0 0 0 0 0 0 0 0 0 9.8100 -3.9720 0.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0170 -2.4090 -0.1970 C 0 0 3 0 0 0 0 0 0 0 0 0 11.8550 -1.7640 0.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0250 -1.5600 -0.8150 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5060 -3.4260 -1.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1160 -2.7510 -2.3210 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5220 -2.0000 -2.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2950 -3.3830 2.0280 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2120 -2.5590 2.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0470 -1.1540 2.2880 O 0 5 0 0 0 0 0 0 0 0 0 0 6.0060 3.8910 -0.0710 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4450 0.7240 -0.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6110 -1.6100 0.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 -2.0620 0.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5810 2.1770 -0.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1740 2.6060 -0.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0090 -1.2810 0.0930 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3740 1.0380 0.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2440 -4.1070 -0.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6750 -4.0140 -1.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1010 4.3350 -0.0950 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8670 4.4190 -0.0840 H 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 33 1 0 0 0 0 2 3 2 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 35 1 0 0 0 0 4 5 2 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 36 1 0 0 0 0 6 37 1 0 0 0 0 7 8 1 0 0 0 0 7 38 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 10 11 1 0 0 0 0 10 32 1 0 0 0 0 11 12 2 0 0 0 0 11 16 1 0 0 0 0 12 13 1 0 0 0 0 12 14 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 39 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 31 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 29 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 40 1 0 0 0 0 26 41 1 0 0 0 0 27 28 1 0 0 0 0 29 30 1 0 0 0 0 32 42 1 0 0 0 0 32 43 1 0 0 0 0 M CHG 1 31 -1 M END