%chk=000170286.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000170286

0 1
 O   -2.157700      -1.633900      -1.972200    
 O    2.443700      -1.033800      -2.116800    
 O  -0.3755000       2.653700      -2.031700    
 O    1.579100      -2.724500      9.6000001E-02
 O   -3.181700      1.5000000E-02  0.1256000    
 O    1.610300       2.704800      8.3700001E-02
 O    1.129700      -3.874600       2.049300    
 O   -3.972600       1.043600       2.037700    
 O    2.911000       2.851000       1.988200    
 N   0.1509000      -1.361000      -1.999500    
 N   -1.293300      0.5178000      -1.988800    
 N    1.055400      0.8289000      -2.028800    
 C   -1.173900     -0.8871000      -1.983000    
 C    1.306800     -0.5556000      -2.050700    
 C  -0.2206000       1.428500      -2.015100    
 C   0.3448000      -2.808100      -1.960200    
 C   -2.652900       1.051300      -1.973200    
 C    2.213200       1.719200      -2.019400    
 C   0.4515000      -3.317800     -0.5345000    
 C   -3.152800       1.262400     -0.5557000    
 C    2.660400       2.037600     -0.6044000    
 C    1.799100      -3.094300       1.390800    
 C   -3.613900      5.4099999E-02   1.419200    
 C    1.874400       3.053900       1.376000    
 C    3.000200      -2.380600       1.871800    
 C   -3.573000      -1.321900       1.956100    
 C   0.6775000       3.727500       1.920800    
 C    3.433700      -2.567300       3.121700    
 C   -3.948500      -1.559800       3.216000    
 C   0.6746000       4.170900       3.181100    
 H    1.257600      -3.063100      -2.510500    
 H  -0.4895000      -3.307000      -2.465500    
 H   -3.320500      0.3617000      -2.502300    
 H   -2.676600       2.004700      -2.512500    
 H    1.955400       2.648100      -2.540700    
 H    3.040500       1.256800      -2.569100    
 H  -0.4545000      -3.064900      2.9100001E-02
 H   0.5718000      -4.407200     -0.5454000    
 H   -2.492400       1.954000     -1.8700000E-02
 H   -4.163600       1.685300     -0.5850000    
 H    2.916500       1.115200     -6.9499999E-02
 H    3.543100       2.686500     -0.6387000    
 H    3.518400      -1.706500       1.199000    
 H   -3.233800      -2.128500       1.315800    
 H  -0.1924000       3.853000       1.285700    
 H    4.314900      -2.041900       3.474500    
 H    2.936500      -3.233700       3.817900    
 H   -3.917100      -2.570200       3.609900    
 H   -4.291100     -0.7743000       3.880500    
 H  -0.2053000       4.664400       3.580600    
 H    1.528300       4.059400       3.840400    


%chk=000170286-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000170286

0 1
O -2.118779 -1.719526 -1.906491
O 2.419284 -0.686332 -2.382925
O -0.761896 2.745487 -2.211490
O 1.276796 -2.282567 0.446766
O -3.730579 0.476765 0.399522
O 1.978114 2.763197 -0.084218
O 0.306734 -3.137525 2.389047
O -1.569412 -0.273884 0.898221
O 3.035494 1.457073 1.548187
N 0.159531 -1.225471 -2.039613
N -1.458624 0.523797 -2.061233
N 0.858447 1.045065 -2.266158
C -1.201265 -0.862673 -1.992006
C 1.225567 -0.319993 -2.234150
C -0.468166 1.521779 -2.169925
C 0.486712 -2.656575 -1.812893
C -2.858681 0.991196 -1.912807
C 1.955958 2.035192 -2.407940
C 0.292788 -3.057753 -0.348860
C -3.182926 1.524059 -0.502457
C 2.815488 2.150229 -1.145706
C 1.158832 -2.392801 1.837556
C -2.813009 -0.355764 1.065041
C 2.176718 2.316896 1.231595
C 2.162393 -1.533214 2.510557
C -3.547030 -1.291921 1.948575
C 1.228604 3.010899 2.138377
C 2.311603 -1.564858 3.860616
C -2.905517 -2.244891 2.676041
C 1.185285 2.721407 3.464407
H 1.533836 -2.794976 -2.123394
H -0.178035 -3.272652 -2.441440
H -3.517466 0.142708 -2.157093
H -3.013608 1.804540 -2.640742
H 1.480325 3.000596 -2.640970
H 2.603202 1.721971 -3.245281
H -0.723924 -2.832693 0.011647
H 0.487676 -4.138288 -0.219151
H -2.296150 1.989662 -0.039467
H -4.001608 2.257932 -0.564082
H 3.198281 1.174792 -0.804767
H 3.667353 2.827544 -1.338354
H 2.756749 -0.867419 1.877799
H -4.635376 -1.174196 1.969551
H 0.570062 3.752193 1.674730
H 3.049429 -0.929805 4.361727
H 1.697943 -2.232422 4.477299
H -3.469868 -2.930352 3.318230
H -1.816863 -2.370698 2.637398
H 0.481960 3.222517 4.137238
H 1.853720 1.963454 3.888989


