PUBCHEM-ZINC04098725 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 0 0 1 0 0 0 0 0999 V2000 0.1600 1.2320 0.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1670 -0.1570 0.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1940 -0.7490 -0.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2110 0.0210 -0.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2140 1.4040 -0.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1730 2.0260 0.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2130 3.4840 0.2730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1300 4.2680 0.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2850 5.7290 0.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3450 6.3140 0.5160 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9430 6.2830 0.2100 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9960 7.7280 0.1340 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.0690 8.1080 -0.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1860 8.3000 1.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7010 9.7160 1.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2150 10.3090 0.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3660 9.6210 -0.8450 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.3460 9.8470 -1.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1770 8.0980 -0.7760 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.0890 7.6040 -0.4230 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9180 7.6200 -2.1100 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4160 8.3550 -2.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3800 10.1280 -1.7590 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6070 10.4960 2.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7260 11.7510 2.8200 O 0 5 0 0 0 0 0 0 0 0 0 0 3.1880 -0.6400 -1.4440 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2170 -2.1060 -0.3610 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6420 1.6860 1.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6190 -0.7660 0.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0070 2.0050 -1.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2030 3.9250 0.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8750 3.8860 0.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8770 7.6630 2.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2240 8.2430 2.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5610 11.3390 0.5360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1830 11.0440 -1.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8160 0.0170 -1.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0240 -2.2610 -0.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4250 9.7730 3.9270 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 27 1 0 0 0 0 4 5 2 0 0 0 0 4 26 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 2 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 19 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 15 16 2 0 0 0 0 15 24 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 23 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 23 36 1 0 0 0 0 24 25 1 0 0 0 0 24 39 2 0 0 0 0 26 37 1 0 0 0 0 27 38 1 0 0 0 0 M CHG 1 25 -1 M END