%chk=000171765.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000171765

0 1
 O   -1.060000     -0.1324000     -0.2061000    
 O    3.014900      -1.724100       1.694100    
 O   0.4446000     -0.9272000      -1.748700    
 O    3.963200      -3.445800     -0.1523000    
 N    1.137900      8.0300003E-02  0.2236000    
 N    3.488500      -2.179200     -0.5182000    
 C    2.957400       2.565800      0.2083000    
 C    3.340500       1.137800      0.6575000    
 C    2.559800     -2.5400000E-02  2.6200000E-02
 C    3.106600       2.790600      -1.296000    
 C    3.821400       3.583700      0.9619000    
 C    3.031000      -1.391800      0.5106000    
 C   0.1980000     -0.3790000     -0.6795000    
 C   -2.138100     -0.5593000      -1.046500    
 C   -3.440400     -0.2162000     -0.3847000    
 C   -4.041000      -1.133900      0.4698000    
 C   -4.034500       1.016400     -0.6316000    
 C   -5.251500     -0.8150000       1.085200    
 C   -5.244900       1.335300     -1.6100001E-02
 C   -5.853400      0.4195000      0.8423000    
 H    1.910600       2.751200      0.4791000    
 H    3.223100       1.080600       1.748800    
 H    4.410700      0.9771000      0.4676000    
 H    2.730800      2.0800000E-02  -1.056600    
 H    2.411900       2.161300      -1.860600    
 H    2.888500       3.831500      -1.558600    
 H    4.123600       2.562200      -1.631700    
 H    3.535000       4.607600      0.6989000    
 H    4.883400       3.457200      0.7254000    
 H    3.698600       3.472600       2.044500    
 H   0.8000000      0.4714000       1.098000    
 H    3.596800      -1.908000      -1.489000    
 H   -2.071000      -1.641600      -1.213200    
 H   -2.065900     -6.2199999E-02  -2.022000    
 H   -3.579800      -2.097500      0.6679000    
 H   -3.568100       1.738000      -1.296600    
 H    4.710800      -3.536300     -0.7670000    
 H   -5.725100      -1.527700       1.754100    
 H   -5.713400       2.296800     -0.2046000    
 H   -6.795800      0.6679000       1.321700    


%chk=000171765-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000171765

0 1
O -1.003818 0.010502 -0.347338
O 3.992977 -1.586593 1.128994
O 0.545700 -1.035071 -1.785030
O 3.154364 -3.645648 -0.365238
N 1.223734 0.223052 0.072597
N 2.764911 -2.296145 -0.672640
C 3.093240 2.648085 0.252470
C 3.451427 1.179447 0.603459
C 2.676635 0.110836 -0.191840
C 3.402311 2.989634 -1.224852
C 3.853891 3.603853 1.202621
C 3.199620 -1.305520 0.160525
C 0.285252 -0.321797 -0.765748
C -2.117458 -0.581299 -1.172424
C -3.410939 -0.295174 -0.452523
C -3.838919 -1.128208 0.612492
C -4.214905 0.809467 -0.828743
C -5.046093 -0.858486 1.293145
C -5.425167 1.080768 -0.151743
C -5.842380 0.247249 0.911521
H 2.005267 2.802322 0.415933
H 3.300781 0.996799 1.685604
H 4.530053 1.014619 0.423113
H 2.824378 0.261307 -1.277926
H 2.796867 2.390944 -1.929824
H 3.189657 4.054601 -1.431046
H 4.470817 2.808811 -1.452032
H 3.593120 4.658373 0.997723
H 4.947871 3.494965 1.073207
H 3.618102 3.393826 2.262695
H 0.902220 0.715208 0.907947
H 2.017195 -2.203380 -1.379411
H -1.916925 -1.661683 -1.280862
H -2.079524 -0.113892 -2.171726
H -3.223068 -1.985887 0.908869
H -3.891488 1.458752 -1.651429
H 3.764964 -3.494248 0.427040
H -5.368169 -1.508367 2.114177
H -6.040237 1.936090 -0.452247
H -6.781564 0.454887 1.436392


