%chk=000054123.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000054123

0 1
 O  -0.3559000       3.635900     -0.2889000    
 O   -2.983100      -2.125100     -0.3122000    
 O    3.354500      -1.511000     -0.3003000    
 O   -2.200900       4.508800      0.7758000    
 O   -2.880100      -4.123400      0.8262000    
 O    5.026700     -0.3713000      0.7971000    
 N   9.9999998E-03 -1.2100000E-02  9.0400003E-02
 N  -0.7502000       5.855300     -0.3944000    
 N   -4.724400      -3.556100     -0.4242000    
 N    5.474600      -2.276900     -0.4092000    
 C   0.3243000       1.343700     -0.3587000    
 C   -1.311900     -0.4154000     -0.3877000    
 C    1.029700     -0.9529000     -0.3719000    
 C  -0.7094000       2.332800      0.1559000    
 C   -1.688000      -1.781900      0.1628000    
 C    2.400100     -0.5626000      0.1584000    
 C   -1.192300       4.650100      9.2500001E-02
 C   -3.472800      -3.336400      9.5700003E-02
 C    4.648900      -1.301500      9.2699997E-02
 H    1.278400       1.703700      3.7300002E-02
 H   0.3943000       1.409400      -1.452700    
 H   -2.107400      0.2487000     -3.9299998E-02
 H   -1.369700     -0.4202000      -1.484400    
 H   0.8578000      -1.968100     -2.7000001E-03
 H    1.058600      -1.021800      -1.467700    
 H   -1.707000       2.139400     -0.2453000    
 H  -0.7460000       2.317400       1.252100    
 H   -1.013700      -2.568600     -0.1850000    
 H   -1.693500      -1.765900       1.259600    
 H    2.730600      0.4076000     -0.2209000    
 H    2.398600     -0.5460000       1.255200    
 H   -1.251700       6.717000     -0.2071000    
 H   9.1899998E-02   5.921300     -0.9563000    
 H   -5.237900      -4.407800     -0.2238000    
 H   -5.174300      -2.873500      -1.025000    
 H    6.470500      -2.276900     -0.2162000    
 H    5.114200      -3.027600     -0.9885000    


%chk=000054123-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000054123

0 1
O -0.038078 3.768645 0.409736
O -3.234951 -1.916278 0.357169
O 3.269935 -1.864828 0.399486
O -2.140978 3.642382 -0.661761
O -2.072521 -3.660898 -0.734415
O 4.236324 0.005615 -0.674543
N 0.004535 0.007116 0.013731
N -0.833828 5.594118 -0.684195
N -4.415727 -3.496805 -0.769447
N 5.249380 -2.113806 -0.687554
C 0.327368 1.413314 -0.320146
C -1.372222 -0.412233 -0.335328
C 1.059722 -0.972785 -0.331849
C -0.179873 2.341927 0.800069
C -1.929721 -1.335486 0.765450
C 2.116164 -1.013521 0.789173
C -1.105178 4.285374 -0.351737
C -3.147441 -3.086847 -0.422472
C 4.260839 -1.212224 -0.360457
H 1.421683 1.521009 -0.424193
H -0.128853 1.727374 -1.285615
H -2.012635 0.483134 -0.426656
H -1.409955 -0.946952 -1.310954
H 0.604113 -1.972331 -0.447855
H 1.560396 -0.724308 -1.294294
H -1.241413 2.136580 1.024353
H 0.427506 2.239238 1.712325
H -1.224192 -2.157584 0.978660
H -2.148556 -0.774526 1.686954
H 2.483498 0.002864 1.016223
H 1.714926 -1.484195 1.699810
H -1.516599 6.110606 -1.230719
H 0.035846 6.030334 -0.387919
H -4.520995 -4.336867 -1.330539
H -5.228378 -2.964146 -0.469023
H 6.042174 -1.791709 -1.234661
H 5.181185 -3.083199 -0.387507


