%chk=000176968.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000176968

0 1
 O   -4.498500      0.8970000      7.1900003E-02
 O  -0.1931000       2.779600     -0.2605000    
 O   -2.845800       3.065600     -0.1191000    
 O    5.236800     -0.5883000     -0.2914000    
 O    4.306900       1.920200      0.4498000    
 N   -1.589500      -3.236600     -0.1109000    
 C  -0.6139000      -2.164000      0.2156000    
 C   -1.210700     -0.7574000      9.7599998E-02
 C   0.6420000      -2.248300     -0.6814000    
 C   -2.607200     -0.5772000      0.1396000    
 C   -2.829900      -3.034400      0.6548000    
 C   -3.531800      -1.761500      0.1909000    
 C  -0.3440000      0.3620000      1.1100000E-02
 C    1.614400      -1.130700     -0.3765000    
 C    1.120600      0.1476000     -3.7500001E-02
 C   -3.146400      0.7106000      6.5200001E-02
 C  -0.9235000       1.641700     -5.9200000E-02
 C   -1.062100      -4.574300      0.1788000    
 C   -2.307800       1.814100     -3.0400001E-02
 C    2.995000      -1.363100     -0.4735000    
 C    2.058300       1.157900      0.2416000    
 C    3.900500     -0.3422000     -0.2030000    
 C    3.432700      0.9154000      0.1599000    
 C   -5.155100      0.9048000      -1.192900    
 C   -3.060400       3.763900       1.104400    
 C    5.890600      -1.051900      0.8886000    
 C    4.722000       2.749500     -0.6333000    
 H  -0.3054000      -2.272500       1.267100    
 H   0.3694000      -2.187700      -1.743400    
 H    1.155400      -3.203100     -0.5240000    
 H   -2.619900      -2.985500       1.732200    
 H   -3.521700      -3.871900      0.4993000    
 H   -4.368500      -1.564300      0.8716000    
 H   -3.943400      -1.925200     -0.8126000    
 H  -0.7287000      -4.671300       1.218200    
 H  -0.2300000      -4.829000     -0.4839000    
 H   -1.826200      -5.338400     -6.8000001E-03
 H    3.362700      -2.346700     -0.7567000    
 H    1.763900       2.143100      0.5862000    
 H  -0.7921000       3.538000     -0.3662000    
 H   -4.876300       1.799400      -1.758500    
 H   -6.234200      0.9275000      -1.017400    
 H   -4.915800      9.6000005E-03  -1.774300    
 H   -3.794800       3.237400       1.722100    
 H   -3.452100       4.756900      0.8676000    
 H   -2.122600       3.881000       1.656700    
 H    6.950300      -1.193900      0.6596000    
 H    5.469900      -2.010500       1.208300    
 H    5.802100     -0.3152000       1.693200    
 H    3.862100       3.265300      -1.072400    
 H    5.235700       2.157800      -1.397400    
 H    5.417700       3.498100     -0.2445000    


%chk=000176968-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000176968

0 1
O -4.611741 0.813998 0.051983
O -0.173172 2.786724 -0.117667
O -2.807860 3.127280 -0.075143
O 5.289559 -0.764178 -0.356859
O 4.364353 1.886609 0.486074
N -1.583119 -3.295182 -0.025702
C -0.605656 -2.196568 0.198298
C -1.241936 -0.801508 0.101793
C 0.569595 -2.261040 -0.804152
C -2.648876 -0.645220 0.106023
C -2.833245 -3.069176 0.741420
C -3.572991 -1.847022 0.186003
C -0.351761 0.324129 0.013228
C 1.585912 -1.187028 -0.467126
C 1.116839 0.098625 -0.050490
C -3.202507 0.658466 0.028112
C -0.942330 1.616252 -0.029731
C -1.011436 -4.627686 0.265675
C -2.350295 1.778379 -0.002443
C 2.969390 -1.442352 -0.545161
C 2.077851 1.099673 0.257181
C 3.917416 -0.447873 -0.224981
C 3.457531 0.842061 0.160979
C -5.182994 1.374678 -1.195720
C -3.565072 3.578706 1.122062
C 6.085443 -0.635641 0.886056
C 5.124681 2.393011 -0.678866
H -0.165893 -2.286960 1.232134
H 0.156926 -2.118011 -1.823504
H 1.055449 -3.250776 -0.780600
H -2.626030 -2.926071 1.833949
H -3.467866 -3.968600 0.641889
H -4.451243 -1.604594 0.810400
H -3.956218 -2.093117 -0.823787
H -0.623641 -4.719228 1.312447
H -0.186921 -4.864265 -0.426589
H -1.793737 -5.393236 0.121579
H 3.339813 -2.427719 -0.848031
H 1.763041 2.101454 0.551504
H -0.823681 3.540042 -0.212459
H -4.748237 2.366765 -1.415404
H -6.264916 1.459671 -1.011579
H -4.997293 0.688430 -2.043341
H -4.459803 2.948378 1.260880
H -3.850906 4.621221 0.914914
H -2.923952 3.526991 2.021698
H 7.123761 -0.853015 0.591800
H 5.742617 -1.377910 1.632146
H 6.003111 0.382539 1.305794
H 4.434322 2.843795 -1.417194
H 5.703917 1.580790 -1.155985
H 5.801403 3.164207 -0.279307


