%chk=000052493.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000052493

0 1
 O  -0.8011000       1.864100      9.9999997E-05
 O   -4.062200      -2.369400     -1.6000000E-03
 N    1.336200      0.3657000     -7.9999998E-04
 C  -0.9827000     -0.4992000      9.9999997E-05
 C   0.4033000     -0.6969000       0.000000    
 C   -1.843200      -1.599000      3.9999999E-04
 C    2.741900      0.3960000     -3.9999999E-04
 C   -2.988100       1.069700       0.000000    
 C   -1.523700      0.8754000      1.9999999E-04
 C   -3.848500     -3.0300001E-02 -1.9999999E-04
 C    3.447300      0.4115000       1.207700    
 C    3.447700      0.4116000      -1.208400    
 C   -3.307500      -1.404800       0.000000    
 C   0.9227000      -1.991700      3.9999999E-04
 C   -1.317600      -2.896700      1.1000000E-03
 C    5.539200      0.4579000      3.0000001E-04
 C    4.841700      0.4425000       1.208000    
 C    4.842200      0.4425000      -1.207900    
 C   6.4199999E-02  -3.089200      1.0000000E-03
 C   -3.513700       2.367300      9.9999997E-05
 C   -5.234600      0.1675000       0.000000    
 C    2.727200      0.3976000       2.517200    
 C    2.728500      0.3959000      -2.518200    
 C   -4.895500       2.559900       0.000000    
 C   -5.754100       1.462500      9.9999997E-05
 C    7.030400      0.4897000      7.9999998E-04
 H   0.9332000       1.295800     -3.8000001E-03
 H    1.992300      -2.183700      3.0000001E-04
 H   -1.965800      -3.769000      1.6000000E-03
 H    5.389700      0.4517000       2.147400    
 H    5.390700      0.4513000      -2.146900    
 H   0.4708000      -4.096400      1.4000000E-03
 H   -2.867700       3.241100      1.9999999E-04
 H   -5.925100     -0.6715000      9.9999997E-05
 H    3.411800      0.5471000       3.359400    
 H    1.987000       1.203500       2.561300    
 H    2.225500     -0.5639000       2.666900    
 H    1.986400       1.200200      -2.562900    
 H    3.413100      0.5471000      -3.360100    
 H    2.229000     -0.5666000      -2.668200    
 H   -5.302600       3.566900      9.9999997E-05
 H   -6.829500       1.615200      9.9999997E-05
 H    7.414400       1.017700      0.8803000    
 H    7.427700     -0.5302000      2.7000001E-03
 H    7.415000       1.014500     -0.8803000    


%chk=000052493-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000052493

0 1
O -0.813251 2.010804 -0.005507
O -4.048508 -2.473238 0.006604
N 1.316546 0.511769 -0.000381
C -0.960702 -0.403885 0.000759
C 0.479105 -0.582480 0.001589
C -1.804325 -1.567534 0.003911
C 2.757917 0.441313 -0.000498
C -3.030322 1.077693 -0.003023
C -1.545538 0.939586 -0.003965
C -3.877024 -0.068287 0.000477
C 3.456612 0.425060 1.239443
C 3.456491 0.432556 -1.240575
C -3.297670 -1.444246 0.004406
C 1.011028 -1.915599 0.004588
C -1.251116 -2.861230 0.007064
C 5.597198 0.377454 -0.000863
C 4.871423 0.394705 1.215708
C 4.871312 0.402152 -1.217222
C 0.157999 -3.025435 0.007208
C -3.605807 2.372827 -0.006397
C -5.284513 0.094940 0.000463
C 2.698309 0.444836 2.553944
C 2.697943 0.459962 -2.554809
C -5.006300 2.527247 -0.006353
C -5.848965 1.385620 -0.002888
C 7.115012 0.313313 -0.001088
H 0.810832 1.426005 -0.001468
H 2.097570 -2.046850 0.004771
H -1.930223 -3.718440 0.009399
H 5.417702 0.387372 2.167343
H 5.417487 0.400557 -2.168939
H 0.587458 -4.033235 0.009525
H -2.933026 3.235651 -0.009152
H -5.907825 -0.804814 0.003263
H 3.392647 0.443997 3.411133
H 2.051911 1.338088 2.635078
H 2.033575 -0.433881 2.651133
H 2.053630 1.355088 -2.631997
H 3.392084 0.461311 -3.412155
H 2.031123 -0.416751 -2.655627
H -5.445890 3.530553 -0.009060
H -6.937291 1.508957 -0.002827
H 7.541667 0.800750 0.893165
H 7.468087 -0.736474 -0.002472
H 7.541525 0.803111 -0.894105


