%chk=000157717.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000157717

0 1
 O   -1.395400      -1.712200     -0.3795000    
 O   -4.158200      -2.020400     -0.4451000    
 O    4.037300       1.503500     -0.3111000    
 N   -2.923800       1.295500      0.6468000    
 C   -3.556900      -1.093200      0.4633000    
 C   -3.555500      0.2885000     -0.1950000    
 C   -2.885200       2.586800     -2.5800001E-02
 C   -2.159100      -1.596000      0.8171000    
 C   -2.101400       2.480300      -1.330900    
 C   -2.264100       3.625000      0.9032000    
 C  -4.5800000E-02  -1.509500     -0.2701000    
 C    2.695700      -1.096500     -4.5200001E-02
 C    4.165600     -0.8757000      7.4600004E-02
 C   0.6033000      -1.823200      0.9192000    
 C   0.6638000     -0.9911000      -1.348100    
 C    1.978200      -1.616000       1.032000    
 C    2.038600     -0.7840000      -1.235400    
 C    4.520100      0.5204000      0.5956000    
 C    4.342700       2.817900      0.1343000    
 H   -4.170000      -1.076200       1.372300    
 H   -3.055700      0.1742000      -1.162200    
 H   -4.591200      0.5749000     -0.4200000    
 H   -3.906200       2.919600     -0.2531000    
 H   -3.431000       1.374200       1.527800    
 H   -2.235800      -2.594700       1.263200    
 H   -1.709400     -0.9094000       1.544600    
 H   -2.665400       1.973400      -2.120000    
 H   -1.145100       1.962900      -1.191900    
 H   -1.873000       3.480200      -1.718900    
 H   -1.232400       3.363100       1.164800    
 H   -2.249600       4.611900      0.4280000    
 H   -2.836600       3.715300       1.833200    
 H    4.605100      -1.633600      0.7349000    
 H    4.630800      -1.024600     -0.9087000    
 H   -5.062400      -1.710500     -0.6238000    
 H    2.479900      -1.868100       1.962600    
 H    2.585000     -0.3787000      -2.082900    
 H   8.8500001E-02  -2.258800       1.770100    
 H   0.1553000     -0.7450000      -2.276000    
 H    4.073900      0.6814000       1.584500    
 H    5.609300      0.6073000      0.6829000    
 H    5.425600       2.955200      0.2116000    
 H    3.952200       3.528900     -0.5987000    
 H    3.867200       3.015700       1.099900    


%chk=000157717-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000157717

0 1
O -1.264624 -0.856558 -0.402032
O -3.802979 -2.233131 -0.914066
O 5.216156 0.688848 -1.098648
N -3.969578 1.229861 0.599528
C -3.623785 -1.179133 0.097172
C -3.923493 0.225517 -0.478296
C -3.627058 2.632894 0.232510
C -2.200787 -1.309304 0.635424
C -2.099693 2.788864 0.062444
C -4.158453 3.574477 1.332525
C 0.107024 -0.931079 -0.116451
C 2.937385 -0.995167 0.246533
C 4.446631 -1.032771 0.447973
C 0.651397 -1.371126 1.114335
C 0.972343 -0.526501 -1.164447
C 2.056937 -1.397455 1.278389
C 2.366366 -0.559844 -0.982894
C 5.147220 0.332580 0.326234
C 5.803034 2.009101 -1.308205
H -4.312056 -1.364936 0.954815
H -3.119434 0.483301 -1.186455
H -4.876468 0.171394 -1.066708
H -4.116483 2.919164 -0.732241
H -4.846883 1.183355 1.133980
H -2.001012 -2.368908 0.889583
H -2.102772 -0.670696 1.535331
H -1.690981 2.049167 -0.648194
H -1.594659 2.631725 1.032696
H -1.851482 3.800099 -0.310703
H -3.724600 3.296280 2.311020
H -3.881793 4.621182 1.115873
H -5.261893 3.524278 1.412476
H 4.673367 -1.442874 1.451002
H 4.925256 -1.707905 -0.288892
H -4.611067 -2.029743 -1.450656
H 2.470269 -1.742973 2.234725
H 3.033005 -0.239372 -1.789487
H 0.006379 -1.691345 1.937640
H 0.529592 -0.199123 -2.110740
H 4.589358 1.114072 0.888406
H 6.180469 0.270838 0.738006
H 6.841276 2.061927 -0.913978
H 5.819284 2.173980 -2.397256
H 5.198185 2.805739 -0.824169


