%chk=000073391.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000073391

1 1
 O   -4.710800       1.086900     -0.9776000    
 O   -2.580400      -2.529300       1.014200    
 O   -3.908100      -2.998300     -0.8234000    
 N   4.3800000E-02   1.875700      0.1835000    
 N    2.199700      -1.076500     -0.2121000    
 C   -2.350700       1.487900     -0.3819000    
 C   -2.211100      8.5400000E-02  0.2252000    
 C   -1.343300       2.409000      0.2875000    
 C  -0.8300000     -0.4454000     -0.1692000    
 C   -3.805000       1.992100     -0.3144000    
 C   0.2875000      0.5486000      2.0199999E-02
 C   -3.357400     -0.7694000     -0.2351000    
 C    1.636500      0.1683000     -3.1199999E-02
 C   -4.339400       2.279900       1.089300    
 C    1.041000       2.776400      0.3241000    
 C   -4.456900     -0.2489000     -0.7958000    
 C    2.688100       1.068400      9.8999999E-02
 C    2.380400       2.419200      0.2868000    
 C    3.910300      0.3315000      1.2000001E-03
 C   -3.331900      -2.224500     -7.4299999E-02
 C    3.571800      -1.006300     -0.1932000    
 C    5.275900      0.6805000      5.8400001E-02
 C    4.528600      -2.017900     -0.3334000    
 C    6.245300     -0.3194000     -7.9700001E-02
 C    5.874800      -1.648100     -0.2727000    
 C   -2.458800      -3.925600       1.304600    
 H   -2.094700       1.421200      -1.451600    
 H   -2.257500      0.1570000       1.321300    
 H   -1.362000       3.394100     -0.1926000    
 H   -1.528800       2.526800       1.361300    
 H  -0.8281000     -0.7488000      -1.224700    
 H  -0.5849000      -1.336000      0.4188000    
 H   -3.862600       2.930900     -0.8793000    
 H   -4.319500       1.388900       1.724500    
 H   -3.771800       3.073300       1.583100    
 H   -5.387100       2.596500       1.034300    
 H   0.7452000       3.809300      0.4758000    
 H   -5.291700     -0.8263000      -1.171300    
 H    3.154900       3.170400      0.4007000    
 H    1.673600      -1.929900     -0.3394000    
 H    5.580400       1.712500      0.2080000    
 H    4.240300      -3.052800     -0.4842000    
 H    7.298400     -5.4299999E-02 -3.5999998E-02
 H    6.643200      -2.409700     -0.3779000    
 H   -1.836500      -4.034000       2.196900    
 H   -1.973100      -4.443900      0.4723000    
 H   -3.443500      -4.357400       1.507800    


%chk=000073391-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000073391

1 1
O -4.709455 1.113351 -1.040158
O -2.343707 -2.655638 0.845148
O -4.290303 -3.023445 -0.391283
N 0.057828 1.937377 0.153329
N 2.169551 -1.088650 -0.219701
C -2.367568 1.529774 -0.399172
C -2.218840 0.120811 0.231583
C -1.349075 2.482603 0.232678
C -0.828397 -0.414790 -0.195048
C -3.816714 2.065308 -0.296546
C 0.294552 0.583067 -0.020220
C -3.366718 -0.769376 -0.222334
C 1.645218 0.189210 -0.050929
C -4.375094 2.255136 1.121194
C 1.085973 2.862071 0.307330
C -4.468830 -0.229177 -0.843193
C 2.740731 1.118333 0.103241
C 2.426713 2.485826 0.287170
C 3.963134 0.352923 0.022082
C -3.412931 -2.228023 0.021897
C 3.577219 -1.020059 -0.179285
C 5.339031 0.694005 0.098964
C 4.526146 -2.054253 -0.304857
C 6.289425 -0.333151 -0.025686
C 5.885097 -1.688371 -0.224668
C -2.395559 -4.091718 1.231598
H -2.148376 1.440795 -1.483719
H -2.222985 0.206441 1.338559
H -1.345981 3.459178 -0.281873
H -1.574912 2.650773 1.301713
H -0.868702 -0.719430 -1.262161
H -0.611705 -1.330378 0.383237
H -3.923004 2.998213 -0.877242
H -4.294317 1.336126 1.725964
H -3.853413 3.074622 1.648198
H -5.440645 2.530476 1.059634
H 0.773201 3.898795 0.443480
H -5.277215 -0.853513 -1.235016
H 3.197382 3.250040 0.409220
H 1.630165 -1.941688 -0.359568
H 5.657060 1.730316 0.250701
H 4.232541 -3.097006 -0.458182
H 7.356504 -0.098599 0.029330
H 6.652643 -2.463521 -0.317553
H -1.538847 -4.235414 1.905151
H -2.317939 -4.732058 0.337555
H -3.344782 -4.309313 1.747240


