%chk=000164622.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000164622

0 1
 O   0.4232000     -0.6031000     -0.2216000    
 O    3.846400      0.1040000     -0.9662000    
 O    1.698500     -0.8470000      -2.119700    
 O    1.179400       1.719800      0.9492000    
 N   -3.821800     -7.5199999E-02  0.8831000    
 C   -2.369600      9.6900001E-02  0.6054000    
 C   -1.876900      -1.241300      5.0299998E-02
 C   -2.261600       1.321000     -0.3008000    
 C   -3.133700      -1.838900     -0.5652000    
 C   -4.207700      -1.418400      0.4261000    
 C   -4.540900      0.9875000      0.1653000    
 C   -3.519500       2.099300      2.7200000E-02
 C  -0.6924000      -1.189700     -0.8993000    
 C    2.683600      0.1571000     -0.1236000    
 C    1.568300     -0.4897000     -0.9544000    
 C    3.022100     -0.6850000       1.143300    
 C    2.370900       1.649200      0.1563000    
 C    4.111600     -8.9299999E-02   2.039800    
 C    3.384700      -2.140900      0.8057000    
 C    2.135500       2.483600      -1.100800    
 H   -1.860100      0.3141000       1.552800    
 H   -1.591100      -1.862100      0.9130000    
 H   -2.280900       1.052100      -1.362700    
 H   -1.358800       1.907200     -0.1101000    
 H   -3.068800      -2.926600     -0.6649000    
 H   -3.332100      -1.409900      -1.554800    
 H   -5.216200      -1.471400      1.7000000E-03
 H   -4.189200      -2.091600       1.291900    
 H   -5.425700       1.312500      0.7208000    
 H   -4.859500      0.6678000     -0.8354000    
 H   -3.401700       2.642400      0.9726000    
 H   -3.782000       2.815800     -0.7564000    
 H  -0.9193000     -0.6169000      -1.804800    
 H  -0.4256000      -2.210100      -1.200600    
 H    2.114000     -0.7407000       1.759000    
 H    3.188000       2.125000      0.7088000    
 H    3.802100      0.8720000       2.459900    
 H    4.326200     -0.7525000       2.885100    
 H    5.044200      6.1000001E-02   1.486400    
 H    2.618400      -2.621900      0.1909000    
 H    4.344400      -2.212000      0.2838000    
 H    3.473200      -2.730800       1.725300    
 H    3.006000       2.473400      -1.762800    
 H    1.926000       3.523400     -0.8253000    
 H    1.260000       2.134500      -1.658400    
 H    3.972400     -0.8085000      -1.274600    
 H    1.389300       1.365700       1.829400    


%chk=000164622-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000164622

0 1
O 0.458308 -0.737340 -0.275274
O 3.999857 -0.008259 -0.842960
O 1.834026 -0.939230 -2.141046
O 1.351206 1.984111 0.923343
N -3.796716 -0.219548 0.859194
C -2.306558 -0.072665 0.615655
C -1.880304 -1.391030 -0.113731
C -2.147152 1.268894 -0.149045
C -3.181658 -1.858703 -0.820498
C -4.265975 -1.484799 0.227247
C -4.483017 1.038438 0.435776
C -3.349945 2.091224 0.375792
C -0.701360 -1.267336 -1.070648
C 2.734866 0.106118 -0.107007
C 1.645653 -0.583280 -0.945823
C 2.898742 -0.580048 1.288394
C 2.444010 1.657467 -0.002960
C 3.997947 0.108926 2.132144
C 3.229302 -2.081677 1.118868
C 2.067162 2.299550 -1.340048
H -1.767678 0.001440 1.578392
H -1.616877 -2.138792 0.660656
H -2.258754 1.118133 -1.242385
H -1.170136 1.742678 0.042926
H -3.173677 -2.934734 -1.070668
H -3.338987 -1.288590 -1.757876
H -5.266061 -1.344940 -0.223813
H -4.350694 -2.291678 0.982923
H -5.281452 1.321012 1.146980
H -4.952361 0.929864 -0.572196
H -3.132862 2.476494 1.389314
H -3.607376 2.949112 -0.269342
H -0.892123 -0.559670 -1.897580
H -0.406612 -2.240117 -1.504596
H 1.921222 -0.502530 1.805048
H 3.401263 2.090543 0.354107
H 3.759182 1.157726 2.392063
H 4.143268 -0.439164 3.080707
H 4.953923 0.108150 1.579839
H 2.438585 -2.618900 0.563307
H 4.181324 -2.201455 0.572945
H 3.330102 -2.564983 2.107321
H 2.815049 2.054054 -2.112149
H 2.024302 3.395529 -1.224803
H 1.073380 1.955115 -1.677828
H 3.782833 -0.391129 -1.739137
H 1.596122 1.697821 1.839172


