%chk=000170754.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000170754

0 1
 O   -4.454800      -2.011600      0.4027000    
 O   -3.692800      -1.052300      -1.503100    
 C   -1.094500      0.1374000      0.2091000    
 C   0.2762000      0.1172000      0.8907000    
 C   -2.263300      0.1363000       1.202700    
 C    1.447400      0.1208000     -9.8300003E-02
 C   -3.662900      0.2423000      0.5731000    
 C    2.814500      2.2500001E-02  0.5832000    
 C    3.987400      2.5800001E-02 -0.4032000    
 C   -3.935300       1.552500     -0.1932000    
 C    5.386600      1.5000000E-02  0.2211000    
 C    6.552800     -4.8900001E-02 -0.7678000    
 C   -3.922600     -0.9786000     -0.3037000    
 C   -5.356600       1.732300     -0.7144000    
 C    7.917900     -1.0600000E-02 -9.8800004E-02
 H   -1.149900       1.028400     -0.4261000    
 H   -1.171200     -0.7326000     -0.4532000    
 H   0.3648000      0.9861000       1.554300    
 H   0.3452000     -0.7748000       1.525600    
 H   -2.134100      0.9699000       1.904500    
 H   -2.208800     -0.7832000       1.800000    
 H    1.406200       1.036800     -0.7003000    
 H    1.333800     -0.7205000     -0.7931000    
 H   -4.396000      0.2060000       1.391200    
 H    2.929900      0.8641000       1.277200    
 H    2.856900     -0.8929000       1.185900    
 H    3.904600      0.9099000      -1.048000    
 H    3.891100     -0.8462000      -1.062500    
 H   -3.257000       1.630300      -1.051000    
 H   -3.702700       2.397800      0.4663000    
 H    5.496600      0.9132000      0.8420000    
 H    5.458300     -0.8418000      0.9031000    
 H    6.472400     -0.9663000      -1.362800    
 H    6.478400      0.7915000      -1.468000    
 H   -6.079600       1.677700      0.1055000    
 H   -5.461300       2.710000      -1.195600    
 H   -5.613900      0.9662000      -1.451500    
 H    8.046600      0.9137000      0.4733000    
 H    8.041400     -0.8572000      0.5839000    
 H    8.711600     -5.9799999E-02 -0.8507000    
 H   -4.620700      -2.794400     -0.1648000    


%chk=000170754-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000170754

0 1
O -4.223761 -2.103930 0.587761
O -3.855521 -1.155617 -1.494934
C -1.109501 0.244847 0.167534
C 0.267655 0.133395 0.860133
C -2.275736 0.223417 1.181155
C 1.452340 0.174812 -0.131193
C -3.709943 0.258755 0.551946
C 2.830424 0.047286 0.556116
C 4.015216 0.093000 -0.435183
C -3.969805 1.519765 -0.305773
C 5.393901 -0.043861 0.249220
C 6.577873 0.004645 -0.743606
C -3.933955 -1.013069 -0.254047
C -5.456430 1.708861 -0.675252
C 7.951721 -0.137272 -0.053359
H -1.141527 1.179753 -0.426413
H -1.222864 -0.586234 -0.557535
H 0.377698 0.956750 1.597301
H 0.309967 -0.811266 1.442180
H -2.191866 1.099409 1.855643
H -2.194035 -0.679385 1.817793
H 1.415671 1.123848 -0.706158
H 1.336515 -0.641618 -0.874404
H -4.429404 0.231763 1.394402
H 2.945230 0.861611 1.302203
H 2.868124 -0.903924 1.127660
H 3.981041 1.046754 -1.002735
H 3.896830 -0.717498 -1.184824
H -3.369354 1.462387 -1.232085
H -3.609975 2.399824 0.263338
H 5.513758 0.764965 1.000517
H 5.430654 -0.999076 0.814213
H 6.455204 -0.801888 -1.495411
H 6.542104 0.960203 -1.306028
H -6.090471 1.781423 0.228932
H -5.602862 2.632127 -1.264638
H -5.821557 0.863071 -1.285571
H 8.111987 0.674644 0.681176
H 8.024896 -1.098567 0.489788
H 8.779815 -0.099064 -0.785078
H -4.327458 -2.923047 0.030517


