%chk=000176888.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000176888

0 1
 O   0.3246000       2.025600      5.4499999E-02
 O  -0.9632000       1.160000      -1.656900    
 N   -3.162200      -1.039800      0.3594000    
 C  -8.5699998E-02 -0.2905000      7.2899997E-02
 C  -0.8496000      -1.448300     -0.6673000    
 C  -0.5952000     -0.1410000       1.535700    
 C   -2.374100      -1.257000     -0.8674000    
 C   -1.915800      0.5905000       1.783300    
 C   -3.058700      0.3551000      0.8027000    
 C    1.427700     -0.6217000      0.1499000    
 C  -0.2419000      -1.783600      -2.048700    
 C  -0.3093000       1.031800     -0.6307000    
 C   -4.570200      -1.361700      8.9900002E-02
 C    2.277500     -0.1630000     -0.8460000    
 C    1.908600      -1.371000       1.213700    
 C    3.638500     -0.4607000     -0.7768000    
 C    3.269700      -1.668500       1.282800    
 C    4.134600      -1.213200      0.2875000    
 C   0.1954000       3.336800     -0.5042000    
 C   0.9493000       4.320100      0.3657000    
 H  -0.7275000      -2.359100     -6.1200000E-02
 H   0.1492000      0.3761000       2.158900    
 H  -0.7163000      -1.139200       1.979400    
 H   -2.606700     -0.5043000      -1.629500    
 H   -2.721400      -2.202700      -1.310000    
 H   -2.256700      0.3149000       2.790900    
 H   -1.727400       1.670900       1.830200    
 H   -3.970900      0.6510000       1.340300    
 H   -3.006500       1.051000     -4.2800002E-02
 H  -0.2142000     -0.9227000      -2.721400    
 H   0.7706000      -2.187000      -1.956800    
 H  -0.8290000      -2.564500      -2.546500    
 H   -4.996700     -0.7270000     -0.6956000    
 H   -5.172900      -1.244400      0.9978000    
 H   -4.677600      -2.409600     -0.2128000    
 H    1.922600      0.4109000      -1.696400    
 H    1.276100      -1.777400       1.994200    
 H    4.311500     -0.1100000      -1.553800    
 H    3.655600      -2.261300       2.107000    
 H    5.193800      -1.447200      0.3400000    
 H   0.6114000       3.344000      -1.517800    
 H  -0.8641000       3.613400     -0.5434000    
 H   0.8712000       5.335300     -3.3100002E-02
 H   0.5561000       4.309900       1.387700    
 H    2.007200       4.045000      0.4295000    


%chk=000176888-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000176888

0 1
O 0.279722 2.141821 0.072357
O -0.739053 1.273122 -1.818201
N -3.174008 -1.023529 0.377977
C -0.098022 -0.248386 0.073044
C -0.842050 -1.440119 -0.661585
C -0.655270 -0.090806 1.537717
C -2.376406 -1.290133 -0.848716
C -1.949936 0.729374 1.743979
C -3.117131 0.406527 0.777483
C 1.413148 -0.607303 0.145222
C -0.232291 -1.811543 -2.037840
C -0.244023 1.086505 -0.680718
C -4.561577 -1.522062 0.242531
C 2.360868 -0.066805 -0.761533
C 1.870354 -1.557585 1.095261
C 3.720036 -0.446112 -0.712203
C 3.228145 -1.943543 1.146001
C 4.163147 -1.387541 0.243825
C 0.246717 3.492110 -0.567240
C 0.881914 4.461651 0.424402
H -0.690811 -2.302165 0.021429
H 0.133306 0.362332 2.165288
H -0.842323 -1.112044 1.915665
H -2.570149 -0.514388 -1.629391
H -2.723894 -2.256087 -1.263037
H -2.279806 0.535135 2.783446
H -1.723818 1.811293 1.678533
H -4.067354 0.672987 1.277726
H -3.051254 1.054823 -0.129996
H -0.352547 -0.985006 -2.758918
H 0.840724 -2.052754 -1.957846
H -0.745792 -2.701870 -2.447458
H -5.142266 -1.029694 -0.578463
H -5.108114 -1.361757 1.189078
H -4.547379 -2.608467 0.040921
H 2.040052 0.652256 -1.524693
H 1.167975 -2.001301 1.808926
H 4.430676 -0.009675 -1.423466
H 3.554693 -2.677690 1.891599
H 5.217265 -1.683887 0.284129
H 0.800399 3.438251 -1.522699
H -0.804497 3.745098 -0.797145
H 0.894181 5.481136 -0.002809
H 0.313734 4.487850 1.370092
H 1.920111 4.165879 0.652125


