%chk=000171232.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000171232

0 1
 O   0.1002000      -1.418100      0.7737000    
 O  -0.2326000      -4.421300      0.2814000    
 O   -3.355900     -0.5464000       2.149400    
 O   -3.654200       3.234400     -0.4516000    
 N   -1.938700     -0.3716000      0.3024000    
 N    2.501200     -0.5058000     -0.5672000    
 N   -3.494600       1.333700      0.8432000    
 N    3.777900     -0.8480000     -0.3861000    
 N    4.386500      0.2137000      0.1308000    
 N    4.074100       3.533400       1.224100    
 C   0.8809000      -2.305200     -5.0500002E-02
 C  -9.4200000E-02  -3.325700     -0.6207000    
 C   -1.393000      -2.556300     -0.6903000    
 C   -1.294100      -1.634500      0.5142000    
 C    1.559500      -1.468100      -1.127100    
 C   -1.542100      0.4006000     -0.7818000    
 C   -2.954300      8.5000001E-02   1.169700    
 C   -2.061300       1.595200      -1.091400    
 C    2.238500      0.7621000     -0.1836000    
 C   -3.136700       2.144300     -0.2234000    
 C   -1.619400       2.410600      -2.264000    
 C    3.457500       1.208500      0.2612000    
 C    3.794600       2.479500      0.7876000    
 H    1.628600      -2.779100      0.5958000    
 H   0.2223000      -3.732100      -1.586000    
 H   -1.448100      -2.030900      -1.648300    
 H   -2.283000      -3.191200     -0.6226000    
 H   -1.703900      -2.134100       1.399200    
 H   0.8810000     -0.9130000      -1.770500    
 H    2.142600      -2.120700      -1.789700    
 H  -0.9016000      -5.021400     -9.0200000E-02
 H  -0.7732000      8.9999998E-04  -1.416900    
 H   -4.227700       1.683100       1.454200    
 H    1.265300       1.225500     -0.2528000    
 H   -2.457100       2.582900      -2.947500    
 H  -0.8239000       1.915300      -2.830700    
 H   -1.235500       3.380700      -1.932000    


%chk=000171232-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000171232

0 1
O 0.137797 -0.876841 0.183659
O -0.059649 -4.217308 0.458835
O -3.332887 -0.599885 2.094436
O -4.573214 3.125041 -0.443537
N -2.130806 -0.139423 0.114205
N 3.046852 -0.830007 -0.503519
N -3.902292 1.261697 0.790931
N 4.428996 -1.102969 -0.722489
N 5.113886 -0.105091 -0.149768
N 4.935926 2.965706 1.701715
C 0.938092 -2.102949 -0.074788
C -0.058398 -3.187997 -0.588209
C -1.411615 -2.446499 -0.705019
C -1.277601 -1.308711 0.330969
C 2.048137 -1.749211 -1.068285
C -1.938464 0.687099 -1.001104
C -3.138012 0.127115 1.083177
C -2.704093 1.796088 -1.264658
C 2.888163 0.335769 0.199639
C -3.786518 2.143650 -0.326207
C -2.489539 2.694810 -2.456311
C 4.196908 0.798872 0.428559
C 4.600532 1.975613 1.121796
H 1.363529 -2.467306 0.879382
H 0.253992 -3.620563 -1.560212
H -1.536444 -2.021066 -1.717649
H -2.271802 -3.100794 -0.487782
H -1.473334 -1.664637 1.357673
H 1.609110 -1.301406 -1.979694
H 2.605778 -2.657912 -1.352509
H -0.642356 -4.972315 0.191717
H -1.098209 0.403685 -1.639668
H -4.640992 1.481546 1.467360
H 1.917016 0.722750 0.490701
H -3.406762 2.755976 -3.069315
H -1.660986 2.336619 -3.090882
H -2.265141 3.726755 -2.131148


