%chk=000154754.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000154754

0 1
 O    4.408900     -0.6683000       1.542500    
 O    4.710700      0.9877000      -1.664400    
 N  -0.6231000       1.139200      0.1491000    
 C    2.578500     -0.7120000      5.0200000E-02
 C    4.065600     -0.4660000      0.1711000    
 C    1.656600      0.3558000      0.1288000    
 C   0.2688000      0.1242000      7.5099997E-02
 C    4.492400      0.9485000     -0.2555000    
 C  -0.1737000      -1.204000     -6.4700000E-02
 C   -1.550700      -1.444700     -0.1226000    
 C    2.108300      -2.019900     -8.1000000E-02
 C    2.180000       1.726700      0.2719000    
 C   -2.464000     -0.3905000     -4.4300001E-02
 C   0.7419000      -2.263000     -0.1427000    
 C    3.475800       1.999500      7.1400002E-02
 C   -1.948200      0.9058000      9.3300000E-02
 C   -2.059000      -2.852600     -0.2712000    
 C   -3.852700     -0.6039000     -9.9900000E-02
 C   -2.848800       1.964700      0.1723000    
 C   -4.733000      0.4708000     -1.8600000E-02
 C   -4.229500       1.758200      0.1179000    
 C   -6.205000      0.2437000     -7.8599997E-02
 H    4.604900      -1.212400     -0.4254000    
 H    5.437000       1.217200      0.2322000    
 H    2.802400      -2.855200     -0.1235000    
 H    1.492500       2.532900      0.5036000    
 H   0.4496000      -3.304800     -0.2176000    
 H    3.816500       3.028900      0.1404000    
 H   -4.295600      -1.590700     -0.1793000    
 H   -2.172300      -3.320300      0.7119000    
 H   -3.006800      -2.922800     -0.8096000    
 H   -1.409200      -3.474600     -0.8931000    
 H   -2.478000       2.982600      0.2791000    
 H    5.375300     -0.5908000       1.616700    
 H    5.422900      0.3578000      -1.868000    
 H   -4.895700       2.614300      0.1816000    
 H   -6.492500     -0.5987000      0.5596000    
 H   -6.763600       1.118500      0.2711000    
 H   -6.511200      3.0800000E-02  -1.107700    


%chk=000154754-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000154754

0 1
O 4.411072 -0.699486 1.609984
O 4.828938 1.090667 -1.675101
N -0.600434 1.125516 0.097424
C 2.608174 -0.707682 0.048916
C 4.091508 -0.429499 0.184123
C 1.687416 0.350754 0.091214
C 0.262655 0.066027 0.044185
C 4.525108 1.008575 -0.222132
C -0.196423 -1.314746 -0.056477
C -1.602699 -1.582221 -0.103153
C 2.150777 -2.057957 -0.053954
C 2.159098 1.738621 0.172159
C -2.506692 -0.476360 -0.050168
C 0.792780 -2.358613 -0.106100
C 3.476864 2.059627 0.042099
C -1.942276 0.869326 0.052965
C -2.079181 -3.018973 -0.208391
C -3.943854 -0.600905 -0.091364
C -2.833558 1.998191 0.110634
C -4.789994 0.506163 -0.035350
C -4.209020 1.824717 0.067739
C -6.299280 0.360853 -0.079463
H 4.658505 -1.141786 -0.459376
H 5.446995 1.249713 0.357967
H 2.892349 -2.864961 -0.076713
H 1.392579 2.506768 0.307148
H 0.475096 -3.402533 -0.183351
H 3.811444 3.102093 0.061632
H -4.395920 -1.594867 -0.170475
H -1.695914 -3.625274 0.633526
H -3.174556 -3.106141 -0.204300
H -1.712212 -3.489334 -1.140299
H -2.374522 2.988585 0.187833
H 5.392079 -0.606605 1.738294
H 5.646813 0.557482 -1.859730
H -4.875504 2.694967 0.111871
H -6.607183 -0.696241 -0.150494
H -6.768139 0.790282 0.826490
H -6.726891 0.897856 -0.947714


