%chk=000130944.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000130944

0 1
 O  -0.8885000      1.5400000E-02   1.092500    
 O  -0.1032000      -2.077500      0.6282000    
 O   0.8204000       2.105800      0.8947000    
 N   -4.325900      0.8506000     -0.8645000    
 N    1.306900     -0.2132000      0.4816000    
 N    2.963200       1.357700      0.2327000    
 C   -3.794400     -0.4625000      -1.276200    
 C   -4.567200      0.6653000      0.5790000    
 C   -4.677500      -1.479600     -0.5452000    
 C   -5.191000     -0.7305000      0.6870000    
 C   -2.334100     -0.5115000     -0.7852000    
 C   -3.186300      0.7323000       1.260700    
 C   -2.219500     -0.3387000      0.7367000    
 C   -5.532900       1.227100      -1.596300    
 C   9.1899998E-02 -0.8691000      0.7246000    
 C    2.506300     -0.8597000      8.2900003E-02
 C    1.594700       1.211500      0.5790000    
 C    3.506300      0.1033000     -6.5399997E-02
 C    3.703200       2.594000      0.1854000    
 C    2.776600      -2.196000     -0.1539000    
 C    4.795000     -0.2214000     -0.4487000    
 C    4.075200      -2.544400     -0.5430000    
 C    5.074800      -1.566900     -0.6887000    
 C    3.606000       3.208300      -1.197900    
 H   -3.810800     -0.6068000      -2.362400    
 H   -5.213500       1.440400       1.005800    
 H   -4.136700      -2.391600     -0.2722000    
 H   -5.526800      -1.775700      -1.172400    
 H   -6.285000     -0.6691000      0.6469000    
 H   -4.924700      -1.243300       1.617000    
 H   -1.887400      -1.464200      -1.093800    
 H   -1.750200      0.2690000      -1.292500    
 H   -2.748700       1.729000       1.111100    
 H   -3.293900      0.6196000       2.346900    
 H   -2.465000      -1.286100       1.234400    
 H   -5.304900       1.340800      -2.661800    
 H   -5.894200       2.200700      -1.247300    
 H   -6.353000      0.5082000      -1.500900    
 H    3.258000       3.284500      0.9106000    
 H    4.744400       2.431300      0.4807000    
 H    2.030700      -2.974000     -5.1300000E-02
 H    5.571200      0.5252000     -0.5681000    
 H    4.315900      -3.586800     -0.7361000    
 H    6.074700      -1.864400     -0.9930000    
 H    4.040200       2.549500      -1.957300    
 H    2.563200       3.395100      -1.476000    
 H    4.142400       4.161800      -1.228400    


%chk=000130944-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000130944

0 1
O -0.871695 0.321464 0.130060
O -0.061484 -1.861303 -0.115330
O 0.969213 2.364196 0.284888
N -4.896852 0.793214 -0.771791
N 1.405969 -0.038475 0.055812
N 3.143578 1.415713 0.202233
C -4.322618 -0.452511 -1.376490
C -4.627244 0.563828 0.685225
C -4.823020 -1.624972 -0.451742
C -5.027752 -0.938148 0.942553
C -2.777630 -0.310082 -1.352968
C -3.115001 0.814056 0.923315
C -2.287693 -0.189701 0.104599
C -6.325970 1.014800 -1.091526
C 0.118115 -0.623448 0.009906
C 2.615141 -0.800246 -0.018281
C 1.732773 1.378298 0.192231
C 3.692133 0.126856 0.071381
C 3.886474 2.680615 0.293781
C 2.850641 -2.179786 -0.145771
C 5.031423 -0.299091 0.037781
C 4.201334 -2.610571 -0.179924
C 5.272728 -1.689225 -0.088810
C 4.406740 3.169653 -1.074687
H -4.666524 -0.559845 -2.419754
H -5.217230 1.269667 1.294864
H -4.095808 -2.455447 -0.411903
H -5.773205 -2.039982 -0.832084
H -6.080346 -1.008841 1.269110
H -4.408718 -1.397196 1.734165
H -2.297094 -1.176163 -1.843561
H -2.505607 0.609054 -1.901949
H -2.868510 1.838632 0.595657
H -2.865417 0.723740 1.996693
H -2.274842 -1.187340 0.580779
H -6.433620 1.152552 -2.182199
H -6.664776 1.944187 -0.600175
H -7.012719 0.190868 -0.779824
H 3.190392 3.422658 0.721442
H 4.721106 2.543659 1.006576
H 2.018313 -2.881323 -0.213011
H 5.859671 0.412610 0.107756
H 4.414879 -3.679992 -0.278428
H 6.305206 -2.053598 -0.117259
H 5.079950 2.429300 -1.541860
H 3.565056 3.357149 -1.763103
H 4.966436 4.113918 -0.948475


