%chk=000171309.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000171309

1 1
 O   -4.796200       1.985800      0.3743000    
 O   -5.955500     -3.4400001E-02 -0.2391000    
 O    4.419100      -1.784600      0.4100000    
 O    6.007000      0.4455000      0.1979000    
 N   0.2463000      -1.421100      0.2355000    
 C  -0.3474000     -0.2005000      9.2799999E-02
 C  -0.5628000      -2.656500      0.3901000    
 C   -1.742900      -2.619800     -0.5614000    
 C   -1.822400     -0.1798000      3.0300001E-02
 C   -2.531100      -1.366200     -0.3050000    
 C   0.4657000      0.9406000     -1.8800000E-02
 C    1.859500      0.8355000      3.2099999E-02
 C    1.592900      -1.540100      0.2949000    
 C    2.435000     -0.4339000      0.1942000    
 C   -2.568600      0.9887000      0.2804000    
 C   -3.930000      -1.379700     -0.4265000    
 C   -3.945900      0.9426000      0.1679000    
 C   -4.607600     -0.2077000     -0.1800000    
 C  -9.6799999E-02   2.294300     -0.3457000    
 C    3.832900     -0.5602000      0.2507000    
 C    2.694900       1.960600     -7.5300001E-02
 C    4.650900      0.5645000      0.1443000    
 C    4.082400       1.824200     -1.8999999E-02
 C   -6.068500       1.359300      0.1133000    
 C    6.689000      0.2427000      -1.038200    
 H  -0.8707000      -2.690000       1.442300    
 H   6.2600002E-02  -3.528700      0.1738000    
 H   -2.361900      -3.510100     -0.4039000    
 H   -1.403700      -2.619300      -1.604000    
 H    1.971400      -2.547500      0.4304000    
 H   -2.156600       1.902700      0.6817000    
 H   -4.462600      -2.284700     -0.6985000    
 H  -0.2899000       2.876500      0.5601000    
 H   0.5595000       2.885200     -0.9924000    
 H  -0.9749000       2.238600     -0.9943000    
 H    2.328300       2.978400     -0.1559000    
 H    4.712600       2.706500     -9.2299998E-02
 H   -6.692800       1.445300       1.010000    
 H   -6.559500       1.891000     -0.7099000    
 H    5.381900      -1.665100      0.4775000    
 H    6.561100       1.112200      -1.690700    
 H    6.325900     -0.6594000      -1.540600    
 H    7.754400      0.1193000     -0.8252000    


%chk=000171309-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000171309

1 1
O -4.798402 2.049624 0.818063
O -6.066870 0.110494 0.182933
O 4.297063 -2.071842 0.438252
O 6.045009 -0.087222 0.011657
N 0.181639 -1.508594 0.126358
C -0.413730 -0.243402 -0.137301
C -0.715932 -2.700086 0.326270
C -1.894343 -2.625848 -0.654636
C -1.891018 -0.184776 -0.039640
C -2.659718 -1.348773 -0.359225
C 0.441575 0.834441 -0.475537
C 1.875061 0.680801 -0.370765
C 1.521786 -1.691748 0.185085
C 2.413297 -0.619972 -0.012063
C -2.553405 1.011111 0.394345
C -4.075881 -1.332116 -0.323178
C -3.943348 1.002875 0.423000
C -4.695568 -0.138091 0.055044
C -0.099572 2.143891 -1.016667
C 3.822478 -0.817645 0.098700
C 2.799443 1.741482 -0.606826
C 4.703848 0.259339 -0.137000
C 4.182501 1.535342 -0.485387
C -6.185214 1.519423 0.674479
C 7.078568 0.942204 -0.206084
H -1.083046 -2.681961 1.368959
H -0.106221 -3.604629 0.174389
H -2.535151 -3.512400 -0.514056
H -1.521009 -2.654050 -1.697256
H 1.892375 -2.698285 0.389765
H -2.002534 1.887769 0.736413
H -4.661529 -2.222105 -0.566559
H -0.076837 2.952010 -0.260820
H 0.516026 2.478996 -1.869148
H -1.133713 2.045628 -1.374752
H 2.438943 2.738797 -0.866315
H 4.865647 2.371886 -0.660875
H -6.674344 1.510662 1.661537
H -6.724779 2.114746 -0.079245
H 5.291805 -2.055183 0.475997
H 6.961691 1.768154 0.518323
H 7.034943 1.322608 -1.242529
H 8.033466 0.427144 -0.035903


