%chk=000091057.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000091057

0 1
 O   -5.124700      0.7553000      0.2785000    
 N   0.9182000     -0.3044000      2.2000000E-02
 C   0.7015000      -1.694100     -0.4345000    
 C    1.795900     -0.2547000       1.193900    
 C    1.945400      -2.585000     -0.4535000    
 C    3.151600     -0.9265000      0.9683000    
 C    3.076800      -2.224500      0.1938000    
 C  -0.4038000      -2.330600      0.4238000    
 C    1.402700      0.5564000      -1.058600    
 C    1.798700      -3.843400      -1.271100    
 C   -1.658000      -1.510600      0.3850000    
 C    4.351100      -3.024600      0.2356000    
 C    1.486200       1.998100     -0.6327000    
 C   -1.853400     -0.5045000       1.325200    
 C   -2.616700      -1.762600     -0.5909000    
 C   0.3873000       2.827300     -0.8091000    
 C    2.660500       2.477500     -6.9300003E-02
 C   -3.020600      0.2584000       1.289200    
 C   -3.783900     -0.9997000     -0.6270000    
 C   -3.985900      1.0900000E-02  0.3131000    
 C   0.4643000       4.163000     -0.4145000    
 C    2.737400       3.813100      0.3255000    
 C    1.639200       4.655800      0.1529000    
 C   -6.069800      0.4494000     -0.7457000    
 H   0.3163000      -1.647200      -1.463700    
 H    1.298700     -0.7915000       2.013200    
 H    1.915100      0.7473000       1.614700    
 H    3.597700      -1.116600       1.952700    
 H    3.836600     -0.2584000      0.4375000    
 H  -8.2999997E-02  -2.473800       1.464100    
 H  -0.6351000      -3.341400      6.1799999E-02
 H   0.7138000      0.5000000      -1.912700    
 H    2.374200      0.2296000      -1.452300    
 H    1.225700      -3.644000      -2.183300    
 H    1.273000      -4.612200     -0.6967000    
 H    2.754500      -4.254600      -1.603500    
 H    5.138300      -2.504900     -0.3203000    
 H    4.253100      -4.030800     -0.1763000    
 H    4.685700      -3.146500       1.271700    
 H   -1.120800     -0.3071000       2.102200    
 H   -2.467900      -2.545900      -1.329400    
 H  -0.5342000       2.453200      -1.246600    
 H    3.538600       1.852900      4.5899998E-02
 H   -3.173700       1.042200       2.026000    
 H   -4.491300      -1.244500      -1.411900    
 H  -0.3910000       4.818900     -0.5482000    
 H    3.654600       4.199100      0.7605000    
 H    1.699700       5.696100      0.4589000    
 H   -5.653700      0.6272000      -1.743100    
 H   -6.912800       1.137400     -0.6237000    
 H   -6.467000     -0.5655000     -0.6365000    


%chk=000091057-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000091057

0 1
O -5.359879 0.718091 -0.152639
N 1.141433 -0.245586 0.176232
C 0.747326 -1.598752 -0.293471
C 2.070216 -0.321250 1.330999
C 1.914159 -2.602096 -0.394151
C 3.378051 -1.075631 0.990721
C 3.123021 -2.356119 0.199408
C -0.418222 -2.177521 0.588822
C 1.611556 0.654560 -0.910822
C 1.600313 -3.868929 -1.181031
C -1.735594 -1.447560 0.397848
C 4.314466 -3.295191 0.132604
C 1.667018 2.114601 -0.472721
C -2.032279 -0.254536 1.112332
C -2.697599 -1.917412 -0.527781
C 0.532163 2.724326 0.122647
C 2.831620 2.893159 -0.678754
C -3.239647 0.439036 0.909315
C -3.916626 -1.234517 -0.751216
C -4.186207 -0.048190 -0.026528
C 0.563370 4.084283 0.499193
C 2.866541 4.257351 -0.303540
C 1.731240 4.856946 0.286804
C -6.365852 0.252970 -1.107591
H 0.326902 -1.475154 -1.313893
H 1.551266 -0.845325 2.155720
H 2.284949 0.704274 1.679825
H 3.921260 -1.319050 1.927306
H 4.064057 -0.419591 0.412103
H -0.099382 -2.142918 1.647551
H -0.546057 -3.245510 0.331295
H 0.883636 0.553816 -1.739913
H 2.605919 0.358758 -1.325162
H 0.769726 -3.692495 -1.890405
H 1.291214 -4.704089 -0.521324
H 2.464453 -4.224261 -1.769353
H 5.231148 -2.740359 -0.150963
H 4.181850 -4.123073 -0.582675
H 4.515806 -3.743764 1.126671
H -1.300965 0.131560 1.830268
H -2.498412 -2.841290 -1.086355
H -0.363447 2.115377 0.288842
H 3.715475 2.430182 -1.136302
H -3.474593 1.353775 1.462795
H -4.635837 -1.633851 -1.472993
H -0.321255 4.545225 0.953943
H 3.775667 4.847149 -0.468451
H 1.754604 5.913090 0.579065
H -5.962336 0.224863 -2.139093
H -7.180958 0.989503 -1.049329
H -6.750180 -0.749874 -0.834953


