%chk=000102544.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000102544

0 1
 O    1.870700      -1.887400      5.4699998E-02
 O   -2.513000       2.172500      0.3063000    
 O   -4.443300       2.317100     -0.8613000    
 O    5.341100       2.393600      0.1493000    
 N   -5.524000      0.2809000      0.7549000    
 C   -3.642100     -0.7812000     -0.4099000    
 C   -4.105000      0.3546000      0.5118000    
 C   -2.166900      -1.076900     -0.2853000    
 C   -1.269000     -0.4078000      -1.101200    
 C   -1.738500      -2.012800      0.6424000    
 C   0.5406000      -1.621400     -5.7200000E-02
 C   9.3900003E-02 -0.6819000     -0.9864000    
 C  -0.3757000      -2.286900      0.7572000    
 C   -3.719800       1.699500     -8.6900003E-02
 C    2.742600     -0.8118000      7.8299999E-02
 C    2.441400      0.2825000      0.8689000    
 C    3.892200     -0.8593000     -0.6893000    
 C    3.319700       1.366000      0.8929000    
 C    4.770600      0.2241000     -0.6653000    
 C    4.484300       1.336600      0.1258000    
 H   -4.189700      -1.705900     -0.1790000    
 H   -3.884700     -0.5575000      -1.458000    
 H   -3.613000      0.2829000       1.489900    
 H   -1.606300      0.3178000      -1.835700    
 H   -2.443900      -2.534300       1.283000    
 H   0.7821000     -0.1661000      -1.650900    
 H  -3.3399999E-02  -3.018800       1.483700    
 H   -5.758000     -0.6106000       1.190500    
 H   -6.032300      0.2996000     -0.1288000    
 H    1.553500      0.3196000       1.493300    
 H    4.116100      -1.724600      -1.305800    
 H    3.087900       2.224800       1.517300    
 H    5.676100      0.1954000      -1.265200    
 H   -2.307300       3.039500     -0.1036000    
 H    4.986800       3.073400      0.7479000    


%chk=000102544-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000102544

0 1
O 1.871385 -1.613229 0.345076
O -3.257803 1.912449 1.441421
O -3.967358 2.141855 -0.756024
O 6.036153 2.138974 -0.237296
N -5.930668 0.183554 0.288569
C -3.789249 -0.928563 -0.566473
C -4.475948 0.051092 0.455236
C -2.293990 -1.095259 -0.353842
C -1.359751 -0.282692 -1.046874
C -1.792103 -2.048475 0.571312
C 0.497894 -1.355693 0.109055
C 0.029385 -0.405230 -0.827545
C -0.409298 -2.182869 0.807908
C -3.892417 1.454787 0.288551
C 2.844948 -0.594904 0.159885
C 2.659943 0.728907 0.617254
C 4.076175 -0.995040 -0.405886
C 3.712170 1.661663 0.490574
C 5.129097 -0.067230 -0.524673
C 4.945026 1.263096 -0.081196
H -4.307662 -1.901150 -0.462969
H -4.001318 -0.543578 -1.582129
H -4.266252 -0.287759 1.483508
H -1.722523 0.450043 -1.777959
H -2.491848 -2.698700 1.111085
H 0.735150 0.215088 -1.388613
H -0.016290 -2.919275 1.515232
H -6.483817 -0.611169 0.613728
H -6.223126 0.556739 -0.618538
H 1.711800 1.027596 1.074765
H 4.195386 -2.029595 -0.740296
H 3.570144 2.690268 0.846453
H 6.091386 -0.353382 -0.958309
H -2.907877 2.832364 1.282019
H 5.816955 3.040516 0.105290


