%chk=000065709.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000065709

0 1
 O   0.2042000      0.7742000      -2.048300    
 O   -5.407100       2.168000       1.411700    
 N    1.534300     -0.6406000     -0.7432000    
 N    3.894100       2.052100      0.3246000    
 N  -0.7389000      -2.321400     -0.6600000    
 C    2.705800      0.2262000     -0.7862000    
 C    2.701800       1.215500      0.3699000    
 C    1.589600      -1.869700     -2.8300000E-02
 C    3.979500       2.760800     -0.9539000    
 C    3.897200       3.007200       1.434600    
 C   0.3733000     -0.2536000      -1.403500    
 C  -0.7908000      -1.206100      -1.309800    
 C   0.4461000      -2.679500     -6.5000001E-03
 C   -2.059400     -0.8131000      -2.014300    
 C    2.742500      -2.294900      0.6515000    
 C    5.252800       3.585100      -1.040600    
 C    3.809200       2.293500       2.773100    
 C   0.4711000      -3.896200      0.6899000    
 C   -2.948700     -2.1299999E-02  -1.104600    
 C    2.755100      -3.508400       1.341600    
 C    1.619500      -4.309600       1.361300    
 C   -2.833700       1.364400      -1.061200    
 C   -3.882700     -0.6781000     -0.3096000    
 C   -3.661200       2.101100     -0.2136000    
 C   -4.710100      5.8600001E-02  0.5378000    
 C   -4.599500       1.448200      0.5859000    
 C   -6.344300       1.437700       2.201800    
 H    2.621800      0.7500000      -1.743600    
 H    3.631500     -0.3539000     -0.8572000    
 H    2.668900      0.6265000       1.291900    
 H    1.785700       1.821200      0.3440000    
 H    4.063100       2.064100      -1.792000    
 H    3.105600       3.399400      -1.132400    
 H    3.080300       3.734900       1.351400    
 H    4.838200       3.566300       1.459200    
 H   -2.576100      -1.724400      -2.342500    
 H   -1.839900     -0.2577000      -2.933000    
 H    3.652400      -1.705000      0.6861000    
 H    5.205400       4.493500     -0.4322000    
 H    6.134100       3.004700     -0.7466000    
 H    5.409100       3.912600      -2.075000    
 H    4.052000       2.996200       3.578400    
 H    4.521600       1.464000       2.840600    
 H    2.802400       1.919000       2.983000    
 H  -0.4122000      -4.530600      0.7121000    
 H    3.651800      -3.824200       1.866800    
 H    1.626600      -5.253200       1.898400    
 H   -2.118000       1.890600      -1.685100    
 H   -3.976300      -1.760400     -0.3378000    
 H   -3.572400       3.183600     -0.1825000    
 H   -5.416400     -0.5117000       1.131600    
 H   -6.902300       2.167200       2.797900    
 H   -7.073200      0.9108000       1.576800    
 H   -5.840400      0.7675000       2.906600    


%chk=000065709-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000065709

0 1
O 0.360226 0.646348 -1.991024
O -5.416348 2.513554 0.891407
N 1.542909 -0.795266 -0.564338
N 3.634183 2.223700 0.415332
N -0.688681 -2.555100 -0.606628
C 2.673293 0.167344 -0.579897
C 2.614014 1.168885 0.602600
C 1.589973 -1.975205 0.203015
C 3.138932 3.350729 -0.425834
C 4.288898 2.663198 1.675066
C 0.397333 -0.437017 -1.321668
C -0.724057 -1.418085 -1.290250
C 0.453204 -2.854309 0.153104
C -1.973752 -1.061302 -2.072866
C 2.708632 -2.329006 1.007400
C 4.264153 4.067832 -1.194997
C 5.287860 1.625751 2.222367
C 0.470108 -4.065500 0.894706
C -2.897227 -0.133063 -1.276437
C 2.698088 -3.533611 1.732523
C 1.580906 -4.410263 1.679723
C -2.784242 1.279892 -1.380310
C -3.877908 -0.667032 -0.407901
C -3.633857 2.129142 -0.648315
C -4.740563 0.171602 0.335797
C -4.616961 1.577306 0.210897
C -6.450624 1.991585 1.785234
H 2.594703 0.728550 -1.524234
H 3.632433 -0.374185 -0.576805
H 2.803482 0.635859 1.551551
H 1.581679 1.585272 0.664897
H 2.417145 2.936530 -1.154301
H 2.569255 4.089347 0.191575
H 3.536245 2.917976 2.463312
H 4.838692 3.596306 1.455440
H -2.495411 -2.004466 -2.307378
H -1.675081 -0.567341 -3.013825
H 3.581609 -1.673867 1.070118
H 5.008968 4.520827 -0.515274
H 4.792436 3.353477 -1.850162
H 3.845651 4.878736 -1.819841
H 5.773105 2.002612 3.141983
H 6.066998 1.417159 1.468668
H 4.792255 0.670284 2.477585
H -0.414244 -4.706153 0.826157
H 3.566703 -3.794647 2.346906
H 1.587951 -5.344479 2.249757
H -2.012348 1.705089 -2.030491
H -3.970623 -1.755097 -0.307608
H -3.557197 3.218099 -0.726152
H -5.492730 -0.275803 0.992749
H -6.946985 2.880651 2.201658
H -7.189022 1.376833 1.233702
H -6.011158 1.391422 2.606307


