%chk=000004157.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000004157

1 1
 O  -0.7057000     -2.2000000E-03  0.4911000    
 O   -1.436900      -1.072900      -1.415200    
 N    3.350600      0.5421000     -3.8699999E-02
 C    2.983900     -0.2978000       1.202700    
 C    2.687000     -0.3084000      -1.142100    
 C    3.305000      -1.732000      0.7505000    
 C    3.112500      -1.738700     -0.7715000    
 C    1.480600     -0.1521000       1.498600    
 C    1.157000     -0.1639000      -1.054900    
 C   0.5907000     -0.5646000      0.3160000    
 C    2.889800       1.997300      1.2900000E-02
 C    4.878300      0.6149000     -0.2326000    
 C   -1.633900     -0.3399000     -0.4531000    
 C   -2.976400      0.3154000     -0.1680000    
 C   -4.139300     -0.5749000     -0.6430000    
 C   -3.059300       1.711100     -0.8126000    
 C   -4.144800      -1.949200      3.3500001E-02
 C   -1.967500       2.659700     -0.3082000    
 C   -4.296800      -1.824300       1.541600    
 C   -2.074600       2.880400       1.192900    
 H    3.595300      3.4899998E-02   2.048100    
 H    3.068500      1.6400000E-02  -2.115900    
 H    4.341400      -1.990900      0.9968000    
 H    2.673900      -2.478400       1.244700    
 H    2.379600      -2.489500      -1.086100    
 H    4.055300      -2.000600      -1.265800    
 H    1.243800      0.8684000       1.821700    
 H    1.217700     -0.7747000       2.364400    
 H   0.7487000     -0.8051000      -1.843300    
 H   0.8482000      0.8506000      -1.330300    
 H   0.4835000      -1.657400      0.3505000    
 H    3.169900       2.475000     -0.9308000    
 H    1.810600       2.066500      0.1464000    
 H    3.392100       2.482000      0.8555000    
 H    5.309200     -0.3859000     -0.2820000    
 H    5.075100       1.148100      -1.167500    
 H    5.301200       1.157300      0.6183000    
 H   -3.074900      0.4254000      0.9163000    
 H   -5.093200     -7.0400000E-02 -0.4437000    
 H   -4.081800     -0.7204000      -1.729100    
 H   -2.962200       1.620700      -1.901800    
 H   -4.044400       2.151900     -0.6157000    
 H   -3.244700      -2.524700     -0.2042000    
 H   -4.993700      -2.521700     -0.3591000    
 H  -0.9662000       2.311300     -0.5759000    
 H   -2.097700       3.625600     -0.8115000    
 H   -5.133300      -1.170600       1.808100    
 H   -4.492100      -2.810800       1.975700    
 H   -3.386600      -1.443100       2.013600    
 H   -1.790600       1.997800       1.770700    
 H   -1.399300       3.688500       1.493900    
 H   -3.090000       3.172400       1.480000    


%chk=000004157-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000004157

1 1
O -0.725435 -0.045263 0.332362
O -1.487859 -0.822461 -1.727955
N 3.430700 0.385172 0.417258
C 2.879537 -0.907675 1.116563
C 2.848969 0.170301 -1.026378
C 3.242934 -2.016166 0.088263
C 3.223110 -1.310468 -1.313004
C 1.356107 -0.772232 1.319121
C 1.324288 0.391558 -1.000452
C 0.611035 -0.581909 -0.021924
C 3.015762 1.689383 1.081135
C 4.957735 0.370632 0.390682
C -1.742760 -0.242588 -0.650481
C -3.069258 0.340022 -0.206732
C -4.159011 -0.773674 -0.206101
C -3.468756 1.504135 -1.165913
C -3.892872 -1.953524 0.759685
C -2.470237 2.685375 -1.225460
C -3.821048 -1.552747 2.250500
C -2.252115 3.403079 0.125901
H 3.401421 -1.012562 2.083019
H 3.347141 0.891193 -1.696978
H 4.226671 -2.463541 0.303701
H 2.505275 -2.831949 0.146617
H 2.475340 -1.757273 -1.986987
H 4.196923 -1.394081 -1.822264
H 1.106063 0.050556 2.010874
H 1.001078 -1.694760 1.811646
H 0.939803 0.219136 -2.020784
H 1.070508 1.435913 -0.747423
H 0.460243 -1.551336 -0.532694
H 3.427162 2.527003 0.496253
H 1.926303 1.782751 1.130668
H 3.431754 1.711837 2.100730
H 5.325624 -0.547546 -0.081779
H 5.310183 1.244202 -0.179416
H 5.330120 0.428191 1.425331
H -2.943557 0.734358 0.815873
H -5.120010 -0.291358 0.061207
H -4.265777 -1.157557 -1.239211
H -3.610359 1.085574 -2.181149
H -4.455782 1.878480 -0.830254
H -2.957928 -2.474038 0.465696
H -4.704572 -2.694130 0.624134
H -1.496171 2.330311 -1.623861
H -2.849597 3.415743 -1.965918
H -4.742239 -1.026714 2.563593
H -3.712567 -2.445017 2.893235
H -2.963229 -0.886396 2.458749
H -1.776541 2.739956 0.872323
H -1.606607 4.291994 0.002176
H -3.213999 3.748710 0.547721


