%chk=000072381.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000072381

0 1
 O    1.678200      -2.382300     -0.7350000    
 O   -1.794800       1.555600      -2.255100    
 N  -0.4892000      0.2339000     -0.2236000    
 N   -3.858800       1.170700      -1.322900    
 N    3.701900      -1.284800     -0.5163000    
 C   0.2645000     -0.4409000      0.8021000    
 C    1.738100     -0.3555000      0.5160000    
 C   -4.105600     -5.2999998E-03  0.7057000    
 C   -1.847700      0.3424000     -0.2088000    
 C    3.834900      0.7746000      0.7431000    
 C   -4.667500      0.6501000     -0.3302000    
 C    2.472600      0.7064000       1.012700    
 C   -2.659000     -0.1515000      0.7400000    
 C   -4.828000     -0.6116000       1.874300    
 C    4.642300       1.910100       1.270100    
 C    4.396700     -0.2369000     -1.9300001E-02
 C    2.380200      -1.317200     -0.2336000    
 C   -2.479600       1.075900      -1.353100    
 C   -6.134800      0.8811000     -0.5449000    
 C   -5.203000      -2.055900       1.610500    
 C    4.688900       3.090400      0.3022000    
 C    5.856100     -0.2184000     -0.3361000    
 C    2.413600      -3.331000      -1.498100    
 H  -3.9900001E-02  -1.492000      0.8836000    
 H   6.7699999E-02  1.2200000E-02   1.782900    
 H  -1.2000001E-03  0.6523000      -1.009600    
 H    1.991300       1.481200       1.603800    
 H   -2.249900     -0.6952000       1.586900    
 H   -5.735300     -4.0199999E-02   2.102000    
 H   -4.220200     -0.5478000       2.785800    
 H    4.212300       2.252600       2.220600    
 H    5.661000       1.597800       1.524100    
 H   -4.315700       1.659800      -2.087800    
 H   -6.361800       1.951100     -0.4916000    
 H   -6.437300      0.5138000      -1.531900    
 H   -6.760500      0.3698000      0.1910000    
 H   -5.855900      -2.147600      0.7359000    
 H   -4.316200      -2.675400       1.439300    
 H   -5.738000      -2.469800       2.471500    
 H    5.136500       2.811700     -0.6566000    
 H    5.282900       3.904300      0.7300000    
 H    3.683100       3.475400      0.1018000    
 H    6.117000      -1.056700     -0.9921000    
 H    6.139700      0.6983000     -0.8602000    
 H    6.453200     -0.3241000      0.5750000    
 H    1.718800      -4.110600      -1.824500    
 H    3.191400      -3.806500     -0.8911000    
 H    2.843800      -2.868000      -2.392500    


%chk=000072381-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000072381

0 1
O 2.139422 -2.901817 -0.246206
O -1.707766 2.621827 -1.163187
N -0.519670 0.344504 -0.239977
N -3.785032 1.940393 -0.305216
N 4.015309 -1.473622 -0.031150
C 0.251287 -0.839830 0.123950
C 1.745515 -0.566402 0.146158
C -4.123421 -0.141534 0.838735
C -1.875837 0.487284 -0.019563
C 3.714134 0.907506 0.404084
C -4.652915 1.055772 0.357134
C 2.307739 0.703185 0.380604
C -2.723240 -0.417054 0.631197
C -4.979968 -1.197574 1.525297
C 4.282215 2.302893 0.610689
C 4.545537 -0.226065 0.185710
C 2.676181 -1.627601 -0.044092
C -2.419837 1.753252 -0.540361
C -6.090364 1.516311 0.446800
C -5.646489 -2.179207 0.524625
C 4.444649 3.083353 -0.722963
C 6.059662 -0.142524 0.190585
C 3.103793 -3.995442 -0.473476
H 0.051501 -1.692822 -0.558466
H -0.068982 -1.179324 1.132876
H -0.110444 1.068638 -0.840173
H 1.640690 1.555175 0.558398
H -2.327138 -1.370209 0.999418
H -5.763074 -0.727045 2.149381
H -4.342781 -1.775612 2.221709
H 3.611589 2.877357 1.278180
H 5.262261 2.248403 1.119955
H -4.157927 2.824669 -0.665477
H -6.168724 2.510977 0.928784
H -6.555796 1.595448 -0.555867
H -6.697853 0.813320 1.035659
H -6.324721 -1.642812 -0.164007
H -4.883365 -2.689441 -0.090462
H -6.234291 -2.950752 1.055934
H 5.117023 2.549756 -1.419354
H 4.866135 4.089068 -0.541813
H 3.469206 3.205448 -1.227116
H 6.476044 -1.118331 -0.103114
H 6.432548 0.629750 -0.506882
H 6.447417 0.112449 1.195778
H 2.475892 -4.888226 -0.612555
H 3.774180 -4.110890 0.395215
H 3.716504 -3.796300 -1.369380


