%chk=000151628.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000151628

0 1
 O   -4.712800       2.304100     -0.8498000    
 O   -6.165800      0.6103000      5.7399999E-02
 O    4.931600       2.095000      5.9500001E-02
 O    5.781600     -0.5199000     -0.3327000    
 N  -0.1850000      -1.788700      0.2942000    
 C  -0.6343000     -0.5136000     -0.3166000    
 C   0.2466000      0.6219000      0.2960000    
 C   -2.134100     -0.2470000     -0.1888000    
 C   -1.120200      -2.886100      3.9900001E-02
 C    1.162700      -2.139500     -0.1863000    
 C    1.725400      0.3166000      0.1106000    
 C   -2.448600      -2.586500      0.7287000    
 C   -3.004200      -1.254200      0.3032000    
 C    2.157700      -1.007900     -7.8100003E-02
 C  -3.1800002E-02  0.8624000       1.790600    
 C   -2.676700      0.9779000     -0.6196000    
 C    2.672200       1.351100      0.1566000    
 C   -4.382100      -1.012600      0.4274000    
 C    3.525800      -1.273500     -0.2320000    
 C   -4.036800       1.177200     -0.4950000    
 C   -4.865400      0.2115000      1.9700000E-02
 C    4.031200       1.074000      1.0800000E-02
 C    4.457500     -0.2372000     -0.1834000    
 C   -6.061300       1.939800     -0.4913000    
 C    5.464600       2.428700       1.339600    
 C    6.302100     -0.5040000      -1.660500    
 H  -0.4469000     -0.5644000      -1.401000    
 H   4.0100001E-02   1.554100     -0.2453000    
 H  -0.7281000      -3.824600      0.4505000    
 H   -1.268800      -3.036500      -1.038000    
 H    1.126400      -2.455800      -1.237500    
 H    1.535200      -2.982300      0.4094000    
 H   -2.319000      -2.580300       1.818300    
 H   -3.158900      -3.384400      0.4813000    
 H   0.5773000       1.688400       2.175100    
 H   -1.078400       1.128300       1.967100    
 H   0.2008000     -1.9900000E-02   2.397300    
 H   -2.051600       1.756500      -1.043300    
 H    2.346700       2.377800      0.3082000    
 H   -5.050700      -1.770000      0.8233000    
 H    3.864100      -2.294600     -0.3941000    
 H   -6.690900       2.000600      -1.386400    
 H   -6.433400       2.656200      0.2502000    
 H    5.999400       1.575600       1.768800    
 H    4.665800       2.750400       2.015400    
 H    6.169300       3.255000       1.212500    
 H    7.368700     -0.7403000      -1.613200    
 H    6.183000      0.4871000      -2.109500    
 H    5.803400      -1.258600      -2.276900    


%chk=000151628-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000151628

0 1
O -4.813953 2.254396 -1.099019
O -6.269650 0.678879 -0.008358
O 4.910510 2.147938 0.093146
O 5.806441 -0.599829 -0.393646
N -0.230951 -1.824630 0.278435
C -0.674566 -0.545388 -0.334293
C 0.182484 0.598282 0.302421
C -2.180020 -0.302206 -0.200497
C -1.203892 -2.929943 0.184306
C 1.114035 -2.202487 -0.194646
C 1.665878 0.281917 0.111328
C -2.477571 -2.549232 0.954809
C -3.043636 -1.239759 0.427236
C 2.106684 -1.050426 -0.106251
C -0.157736 0.818200 1.798954
C -2.708268 0.905067 -0.751634
C 2.627757 1.319650 0.180728
C -4.442769 -0.980559 0.537243
C 3.486722 -1.307126 -0.286953
C -4.074923 1.137612 -0.625968
C -4.928271 0.214828 0.012688
C 4.002532 1.060841 0.029553
C 4.437409 -0.270687 -0.234474
C -6.219373 2.005558 -0.680278
C 5.854738 2.083645 1.232594
C 6.451161 0.017115 -1.576112
H -0.438995 -0.549833 -1.433713
H -0.037754 1.537754 -0.244697
H -0.741319 -3.830342 0.630944
H -1.462990 -3.179517 -0.877090
H 1.084781 -2.567858 -1.257899
H 1.474295 -3.050325 0.419636
H -2.220583 -2.453527 2.028032
H -3.232146 -3.353754 0.865882
H 0.506988 1.582095 2.240430
H -1.202953 1.154377 1.921678
H -0.024117 -0.126645 2.352938
H -2.064374 1.626427 -1.262803
H 2.318510 2.355697 0.361537
H -5.111519 -1.704314 1.012090
H 3.850315 -2.323812 -0.476735
H -6.861539 1.977751 -1.577120
H -6.522261 2.784614 0.041647
H 6.446183 1.150483 1.203874
H 5.300873 2.146801 2.188789
H 6.510788 2.960649 1.121215
H 7.506349 -0.293386 -1.530577
H 6.368149 1.118390 -1.542220
H 5.985947 -0.365282 -2.504850


