%chk=000074778.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000074778

0 1
 O    2.797900       1.323300     -0.2742000    
 O    1.965900     -0.8026000      0.2317000    
 O    8.497700      -1.309700     -0.9076000    
 O    8.549700     -0.7965000       1.226200    
 N    7.963600     -0.8207000      0.1170000    
 C   -5.746300     -0.4015000      0.1830000    
 C   -4.583100      0.5646000     -4.7499999E-02
 C   -7.094000      0.2915000     -2.4499999E-02
 C   -3.234700     -0.1359000      0.1271000    
 C   -8.257700     -0.6826000      0.1731000    
 C   -2.071700      0.8227000     -0.1363000    
 C   -9.602900      5.5999998E-03 -6.8400003E-02
 C  -0.7221000      0.1285000      7.1900003E-02
 C   -10.80380     -0.9179000      0.1461000    
 C   0.4594000       1.070800     -0.1570000    
 C   -12.13970     -0.2593000     -0.1615000    
 C    1.801200      0.3827000     -2.3600001E-02
 C    4.085100      0.7898000     -0.1767000    
 C    4.699400      0.2406000      -1.302200    
 C    4.755800      0.8054000       1.046200    
 C    5.984400     -0.2930000      -1.204700    
 C    6.040800      0.2717000       1.143600    
 C    6.655200     -0.2774000      1.8200001E-02
 H   -5.693000     -0.8067000       1.200800    
 H   -5.660500      -1.249300     -0.5076000    
 H   -4.656600       1.403600      0.6550000    
 H   -4.649500      0.9832000      -1.059100    
 H   -7.190000       1.128100      0.6783000    
 H   -7.137400      0.7125000      -1.036400    
 H   -3.169400     -0.9876000     -0.5608000    
 H   -3.159800     -0.5361000       1.145600    
 H   -8.152800      -1.530000     -0.5151000    
 H   -8.230000      -1.087300       1.192000    
 H   -2.133400       1.206100      -1.161900    
 H   -2.145700       1.685000      0.5374000    
 H   -9.694900      0.8710000      0.5997000    
 H   -9.628400      0.3942000      -1.094100    
 H  -0.6688000     -0.2785000       1.089500    
 H  -0.6448000     -0.7277000     -0.6101000    
 H   -10.69630      -1.805900     -0.4883000    
 H   -10.81050      -1.268900       1.184900    
 H   0.3977000       1.492900      -1.166600    
 H   0.4218000       1.888200      0.5718000    
 H   -12.29990      0.6144000      0.4781000    
 H   -12.18290      6.6699997E-02  -1.205500    
 H   -12.95970     -0.9634000      1.0300000E-02
 H    4.181600      0.2262000      -2.257300    
 H    4.282100       1.232300       1.926000    
 H    6.431700     -0.7125000      -2.102300    
 H    6.533000      0.3010000       2.112400    


%chk=000074778-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000074778

0 1
O 2.869794 0.639690 -0.454714
O 1.943988 -1.080947 0.872522
O 9.224285 0.914054 -0.456622
O 8.951072 -0.894449 0.908330
N 8.485365 0.057911 0.169533
C -5.907445 -0.351638 0.322427
C -4.648623 0.291878 -0.301587
C -7.228999 0.215483 -0.243070
C -3.328019 -0.277827 0.263085
C -8.488175 -0.427163 0.381499
C -2.069560 0.370617 -0.356391
C -9.810222 0.140159 -0.182877
C -0.755539 -0.211075 0.209349
C -11.069214 -0.504214 0.441405
C 0.486749 0.460005 -0.408001
C -12.385509 0.068560 -0.127302
C 1.791834 -0.116058 0.102724
C 4.247703 0.397426 -0.224737
C 5.090953 1.317880 -0.896628
C 4.785378 -0.640398 0.580120
C 6.484546 1.212398 -0.771518
C 6.184939 -0.743630 0.702896
C 7.016715 0.177039 0.031201
H -5.887036 -0.204248 1.422636
H -5.879261 -1.448947 0.155978
H -4.676981 1.388924 -0.132950
H -4.670415 0.146067 -1.402044
H -7.257597 1.312920 -0.076966
H -7.250074 0.067714 -1.343304
H -3.298647 -1.373885 0.090651
H -3.308919 -0.136087 1.363799
H -8.460437 -1.524601 0.215061
H -8.467039 -0.279915 1.481825
H -2.092622 0.232555 -1.457893
H -2.099261 1.466195 -0.178601
H -9.840465 1.237381 -0.015378
H -9.832887 -0.006140 -1.283325
H -0.733108 -0.085961 1.309133
H -0.716307 -1.301341 0.023619
H -11.038016 -1.600302 0.273373
H -11.045316 -0.358245 1.540840
H 0.483060 0.359219 -1.512197
H 0.492464 1.550296 -0.213523
H -12.455346 1.157576 0.055906
H -12.447230 -0.091094 -1.220536
H -13.269476 -0.409029 0.334213
H 4.633437 2.101540 -1.506532
H 4.129368 -1.342305 1.093917
H 7.161138 1.906354 -1.276066
H 6.638655 -1.528740 1.313318


