PUBCHEM-ZINC04787880 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 27 0 0 1 0 0 0 0 0999 V2000 0.1270 1.6180 -0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0210 0.0900 -0.0380 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6520 -0.2880 -0.8540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.3750 -0.1960 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0420 0.0880 0.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5210 -1.9160 -0.0920 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1440 -2.3570 -1.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7120 -2.4560 1.1000 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6330 -3.5490 1.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6720 -1.8050 1.2310 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3420 -2.1390 0.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5480 -0.3880 1.2150 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2200 -2.1980 2.4820 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9350 0.0450 -1.4610 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8920 0.2020 -1.3730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4920 1.9920 0.1540 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8050 1.4990 0.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2270 2.0560 -0.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4420 2.0490 0.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1520 -1.9140 2.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5180 -2.1670 2.3410 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.2490 -2.7940 3.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5150 -2.2880 2.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3630 -1.2020 2.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9360 -2.3400 0.0790 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0110 -3.3450 -0.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4930 -1.9180 -0.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 16 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 12 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 14 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 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 10 13 1 0 0 0 0 13 20 1 0 0 0 0 14 15 1 0 0 0 0 16 17 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 24 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 M CHG 1 21 1 M END