PUBCHEM-ZINC01293202 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 39 0 0 1 0 0 0 0 0999 V2000 0.2550 1.4470 -0.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0700 0.0020 -0.0010 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9170 -0.0850 0.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1640 -0.4050 0.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1000 -1.8360 1.2730 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9350 -2.7430 0.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0740 -2.2140 -0.8960 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1300 -2.7340 -1.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1140 -0.8190 -1.1780 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5320 -2.5120 -0.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4580 -2.2660 2.5360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7410 -3.2400 3.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4990 -3.8050 2.8770 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1360 -4.7650 3.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5610 -5.1810 4.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6540 -4.5950 5.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3030 -3.6300 4.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4330 -3.1020 4.9680 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0030 -2.1480 4.2290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5720 -1.6960 3.0490 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2330 -6.2190 5.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6320 -6.5520 6.7860 O 0 5 0 0 0 0 0 0 0 0 0 0 1.2100 1.5800 -0.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5300 1.7300 -1.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2190 2.1350 0.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1540 -0.1810 0.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0430 0.1910 1.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9160 -2.8080 -0.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6800 -3.7660 0.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8390 -2.0550 0.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1930 -2.1070 -1.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7040 -3.5910 -0.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9970 -3.4830 1.9710 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0880 -5.1840 3.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1040 -4.8990 6.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9070 -1.6990 4.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3450 -6.6810 5.3130 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 9 1 0 0 0 0 4 5 1 0 0 0 0 4 26 1 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 6 29 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 30 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 20 2 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 16 2 0 0 0 0 15 21 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 18 19 2 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 21 22 1 0 0 0 0 21 37 2 0 0 0 0 M CHG 1 22 -1 M END