%chk=000084624.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000084624

0 1
 O   -2.565600       1.894500      0.7208000    
 O   -3.215700       1.403800      -1.434600    
 O    2.994200      -1.770000      0.8365000    
 O    2.069500       2.072100     -0.1387000    
 N    1.304300      -1.965200     -0.7488000    
 N   -4.416300     -0.8974000     -0.6387000    
 N    3.817800      0.5576000     -0.4146000    
 C   -1.540300      -1.509000      0.1060000    
 C   -2.618100     -0.9831000       1.064500    
 C  -0.5264000      -2.388100      0.8466000    
 C   -3.710200     -0.1379000      0.3921000    
 C   0.5274000      -2.976500     -8.6199999E-02
 C   -3.148100       1.121400     -0.2451000    
 C    2.484100      -1.438800     -0.2309000    
 C    3.111400     -0.4327000      -1.172100    
 C   -1.999100       3.127700      0.2666000    
 C    3.236700       1.735500      4.3000001E-02
 C    4.194500       2.585900      0.8335000    
 H   -1.026300     -0.6633000     -0.3646000    
 H   -2.002000      -2.096800     -0.6957000    
 H   -2.132800     -0.3950000       1.853800    
 H   -3.093800      -1.835500       1.567700    
 H  -3.6400001E-02  -1.795100       1.628700    
 H   -1.051100      -3.210800       1.346800    
 H   -4.444600      0.1739000       1.144600    
 H    1.200400      -3.625500      0.4848000    
 H   5.3199999E-02  -3.585800     -0.8629000    
 H   0.9681000      -1.633400      -1.648000    
 H   -4.812500      -1.742500     -0.2292000    
 H   -5.205200     -0.3528000     -0.9856000    
 H    2.351900      5.6100000E-02  -1.790300    
 H    3.825600     -0.9510000      -1.818400    
 H    4.789000      0.3689000     -0.1832000    
 H   -1.574600       3.645400       1.130900    
 H   -2.773900       3.760600     -0.1764000    
 H   -1.198600       2.933300     -0.4537000    
 H    5.161800       2.644000      0.3263000    
 H    3.791800       3.597600      0.9333000    
 H    4.330100       2.150800       1.827300    


%chk=000084624-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000084624

0 1
O -2.133749 2.083053 0.714326
O -3.036864 1.287700 -1.281733
O 3.533778 -2.892038 -0.457473
O 1.386056 1.175332 -0.836177
N 1.495932 -1.781291 -0.807693
N -4.517689 -0.712493 0.145551
N 3.532900 0.507110 -0.271641
C -1.450026 -1.431032 0.219363
C -2.324126 -0.841792 1.348123
C -0.365092 -2.391984 0.758738
C -3.485153 0.068311 0.843050
C 0.629048 -2.870569 -0.323952
C -2.895231 1.193644 -0.040046
C 2.870211 -1.867479 -0.809225
C 3.572349 -0.568593 -1.282164
C -1.388679 3.118825 -0.056102
C 2.435062 1.326216 -0.119260
C 2.545045 2.421954 0.931803
H -0.973984 -0.597155 -0.335659
H -2.083299 -1.977892 -0.508146
H -1.685260 -0.252790 2.033743
H -2.794971 -1.656423 1.929385
H 0.202630 -1.900747 1.574211
H -0.855691 -3.282224 1.200873
H -3.940989 0.541304 1.732140
H 1.300062 -3.654163 0.068949
H 0.067906 -3.305420 -1.176555
H 1.083942 -0.871257 -1.060459
H -5.425715 -0.236799 0.108812
H -4.225489 -0.986674 -0.800240
H 3.088860 -0.188995 -2.200080
H 4.622852 -0.818633 -1.495569
H 4.319756 0.595406 0.372599
H -1.063936 3.849323 0.699604
H -2.049707 3.585637 -0.804796
H -0.525098 2.642486 -0.551743
H 3.487036 2.386047 1.505001
H 2.471587 3.406184 0.436817
H 1.695939 2.340811 1.631724


