%chk=000127667.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000127667

0 1
 O    5.264400      -1.374700     -0.2171000    
 O   -4.333600      0.5956000      -1.826700    
 O   -4.782800      -1.398700     -0.8463000    
 N   0.7628000     -0.4339000      0.2280000    
 N    2.953400      -1.215700     -1.8900000E-02
 N    2.666300      0.9767000      0.3350000    
 N   -4.429500     -0.4147000       1.658600    
 C   -1.643000     -1.1900000E-02  0.4125000    
 C   -2.736400       1.052800      0.5963000    
 C  -0.2388000      0.5904000      0.4060000    
 C   -4.171700      0.5069000      0.5525000    
 C    4.125500      0.7325000      0.2254000    
 C    2.096100     -0.1838000      0.1909000    
 C    4.233700     -0.7493000     -3.2099999E-02
 C    4.697600       1.548600     -0.9167000    
 C   -4.464000     -0.2209000     -0.7475000    
 H   -1.799900     -0.5536000     -0.5281000    
 H   -1.703100     -0.7553000       1.216300    
 H   -2.575000       1.572900       1.549400    
 H   -2.620400       1.810900     -0.1891000    
 H  -0.1587000       1.324900     -0.4039000    
 H  -6.2399998E-02   1.116100       1.351600    
 H   -4.885600       1.334400      0.6337000    
 H   0.4413000      -1.389700      0.1021000    
 H    4.610600      0.9736000       1.176800    
 H    2.683200      -2.182100     -0.1592000    
 H    4.224100       1.288700      -1.870400    
 H    4.539000       2.618600     -0.7472000    
 H    5.772900       1.371500      -1.022100    
 H   -4.203400      4.0500000E-02   2.542200    
 H   -3.816500      -1.225800       1.594500    
 H   -4.522100      0.1241000      -2.666100    


%chk=000127667-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000127667

0 1
O 5.437078 -1.400358 -0.123916
O -4.757527 0.569319 -1.716565
O -4.675240 -1.496157 -0.659323
N 0.766165 -0.523096 0.102192
N 3.061039 -1.299317 -0.063088
N 2.648860 0.943064 0.327357
N -4.378913 -0.271983 1.805095
C -1.649966 -0.008850 0.258842
C -2.704694 1.102228 0.436884
C -0.218838 0.556404 0.291547
C -4.170285 0.560796 0.627338
C 4.130545 0.747746 0.273005
C 2.112664 -0.249496 0.128624
C 4.363312 -0.764386 0.009208
C 4.804914 1.628643 -0.799472
C -4.564854 -0.250708 -0.602252
H -1.818777 -0.533720 -0.703915
H -1.774644 -0.759351 1.065823
H -2.465360 1.702412 1.337537
H -2.690532 1.792103 -0.428226
H -0.079887 1.324120 -0.495727
H -0.020230 1.061690 1.257159
H -4.832646 1.449665 0.651179
H 0.433997 -1.467596 -0.082801
H 4.566645 0.993870 1.261981
H 2.866971 -2.285058 -0.240250
H 4.382873 1.419223 -1.797687
H 4.631966 2.692699 -0.566783
H 5.890840 1.431037 -0.822649
H -4.030718 0.078347 2.695018
H -4.352385 -1.281501 1.659888
H -4.988372 0.007810 -2.505623


