%chk=000174622.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000174622

0 1
 O   -2.541500       2.028500      0.3754000    
 O   -2.220800      -2.037400     -3.4000002E-02
 O   -3.345200     -0.2749000      -1.010100    
 N   0.4395000     -1.9400001E-02   1.107100    
 C  -0.4591000      0.9333000      0.7193000    
 C   0.1462000       1.740300     -0.2201000    
 C   -1.836500       1.122100       1.258500    
 C  -0.5883000       2.885100     -0.8182000    
 C    1.459400       1.245900     -0.4365000    
 C    1.618100      0.1414000      0.4083000    
 C   -1.800700       3.222600      6.5499999E-02
 C   -2.636900     -0.1699000       1.313300    
 C    2.804100     -0.5999000      0.4633000    
 C    2.534600       1.626400      -1.263900    
 C    2.980200      -1.777700       1.362700    
 C    3.855500     -0.2035000     -0.3680000    
 C    3.725100      0.8920000      -1.218900    
 C   -2.793700     -0.7973000     -5.1199999E-02
 C    2.564300      -3.085000      0.6942000    
 C   -2.289100      -2.764800      -1.264700    
 C   -1.615000      -4.107800      -1.081800    
 H   -1.793700       1.578800       2.254300    
 H   5.6299999E-02   3.762900     -0.9274000    
 H  -0.9359000       2.587800      -1.814900    
 H   0.2675000     -0.7377000       1.796900    
 H   -1.497300       3.711200      0.9997000    
 H   -2.469700       3.905500     -0.4674000    
 H   -3.651500      2.1800000E-02   1.683500    
 H   -2.176800     -0.8841000       2.006400    
 H    2.448000       2.478600      -1.931900    
 H    4.026900      -1.850700       1.683400    
 H    2.398800      -1.641200       2.282400    
 H    4.795100     -0.7518000     -0.3607000    
 H    4.556700       1.181100      -1.856000    
 H    1.509000      -3.061100      0.4033000    
 H    2.708600      -3.924000       1.382000    
 H    3.157800      -3.276500     -0.2062000    
 H   -3.338200      -2.911900      -1.544100    
 H   -1.778500      -2.198500      -2.051700    
 H   -1.652800      -4.693200      -2.004700    
 H  -0.5683000      -3.976800     -0.7895000    
 H   -2.099800      -4.676800     -0.2817000    


%chk=000174622-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000174622

0 1
O -2.605866 1.994949 0.374701
O -1.634975 -2.056617 0.103186
O -3.427206 -0.997618 -0.958271
N 0.503746 -0.045001 1.041985
C -0.439582 0.921840 0.656815
C 0.137682 1.806837 -0.250757
C -1.839228 1.051369 1.208254
C -0.628190 2.980708 -0.808886
C 1.499475 1.360759 -0.473297
C 1.699292 0.189307 0.341890
C -1.858495 3.240332 0.090564
C -2.682161 -0.250790 1.285006
C 2.923864 -0.524415 0.384743
C 2.572099 1.837992 -1.272126
C 3.101167 -1.768645 1.242894
C 3.963738 -0.017147 -0.426700
C 3.794895 1.140891 -1.241445
C -2.662179 -1.095404 0.022286
C 2.419168 -3.031213 0.646706
C -1.476220 -2.952933 -1.086882
C -2.394952 -4.172165 -0.972118
H -1.793413 1.458865 2.247527
H -0.002798 3.895225 -0.841980
H -0.959167 2.775805 -1.845983
H 0.264901 -0.919522 1.506120
H -1.538149 3.703723 1.049672
H -2.597347 3.893893 -0.400862
H -3.722326 0.059236 1.481665
H -2.322731 -0.861520 2.131683
H 2.451530 2.728309 -1.899520
H 4.180828 -1.973070 1.366003
H 2.701100 -1.588063 2.261937
H 4.933570 -0.530268 -0.421360
H 4.637246 1.492129 -1.848168
H 1.329136 -2.886399 0.528072
H 2.575941 -3.909661 1.299641
H 2.835532 -3.262278 -0.350003
H -1.696910 -2.365914 -1.995130
H -0.410046 -3.230548 -1.066118
H -2.206126 -4.861374 -1.816134
H -2.210189 -4.720485 -0.031942
H -3.454256 -3.867718 -1.007766


