%chk=000027166.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000027166

1 1
 O   -3.925100      -1.430300     -1.3800000E-02
 O   -4.567500      0.8320000      0.5087000    
 O   -1.242700      -2.200600     -0.6102000    
 N    1.651900      0.8339000     -0.5481000    
 C    3.762900      0.1523000      0.4548000    
 C    5.250200     -0.1860000      0.2531000    
 C    3.046900      0.5166000     -0.8430000    
 C  -0.5940000      0.1094000     -0.2987000    
 C  -0.9699000       1.446500      9.3000000E-03
 C   0.7479000     -0.1538000     -0.5748000    
 C    5.455400      -1.353700     -0.7128000    
 C    5.897100     -0.5104000       1.601800    
 C    1.329200       2.100400     -0.2619000    
 C   -1.560400     -0.9104000     -0.3208000    
 C   1.4700000E-02   2.440800      2.3600001E-02
 C   -2.867800     -0.5735000     -3.7099998E-02
 C   -3.234100      0.7166000      0.2609000    
 C   -2.314200       1.745300      0.2924000    
 C   -4.999200     -0.5327000      0.3326000    
 C  -0.8813000      -3.042700      0.4841000    
 H    3.677300      0.9869000       1.162400    
 H    3.253300     -0.6984000      0.9259000    
 H    5.757000      0.6946000     -0.1617000    
 H    3.510000       1.384800      -1.326000    
 H    3.055700     -0.3026000      -1.569700    
 H    1.122200      -1.141600     -0.8180000    
 H    6.512800      -1.636400     -0.7603000    
 H    5.149800      -1.090900      -1.730000    
 H    4.885000      -2.234300     -0.3988000    
 H    5.789300      0.3292000       2.296700    
 H    6.967700     -0.7082000       1.482700    
 H    5.438400      -1.392600       2.061300    
 H    2.127000       2.833800     -0.2589000    
 H  -0.2314000       3.473400      0.2552000    
 H   -2.630100       2.756600      0.5308000    
 H   -5.458600     -0.8787000       1.265700    
 H   -5.752400     -0.5628000     -0.4631000    
 H   -1.731200      -3.171800       1.161700    
 H  -2.6900001E-02  -2.630900       1.030300    
 H  -0.6016000      -4.021200      8.4299996E-02


%chk=000027166-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000027166

1 1
O -3.979499 -1.440071 0.409989
O -4.531705 0.859237 0.758680
O -1.047184 -2.290658 -0.282218
N 1.741845 0.709480 -0.560070
C 4.010724 0.279292 0.462891
C 5.513522 -0.014786 0.192707
C 3.173189 0.339830 -0.833174
C -0.551983 0.048440 -0.145459
C -0.924855 1.441912 0.075497
C 0.788369 -0.260166 -0.456738
C 5.734630 -1.401481 -0.459482
C 6.305523 0.096803 1.517272
C 1.416546 2.047363 -0.351453
C -1.533076 -1.020549 -0.054058
C 0.118472 2.418938 -0.043405
C -2.837024 -0.630388 0.254023
C -3.176273 0.743919 0.465908
C -2.267734 1.793355 0.388199
C -5.108943 -0.514688 0.715869
C -1.963352 -3.462367 -0.237582
H 3.923776 1.245144 0.999491
H 3.600073 -0.502627 1.132806
H 5.896683 0.763527 -0.501733
H 3.586298 1.092659 -1.528594
H 3.170287 -0.633731 -1.349652
H 1.097278 -1.292933 -0.626733
H 6.813972 -1.598349 -0.583173
H 5.275648 -1.484292 -1.462506
H 5.321733 -2.206452 0.178694
H 6.185722 1.092023 1.983839
H 7.383859 -0.064370 1.342238
H 5.967297 -0.664735 2.245373
H 2.232614 2.764167 -0.453408
H -0.105773 3.478047 0.106744
H -2.570954 2.828167 0.557266
H -5.520153 -0.760760 1.706991
H -5.849824 -0.565299 -0.097576
H -2.744376 -3.367194 -1.008878
H -2.418400 -3.555624 0.761301
H -1.313654 -4.322184 -0.449288


