%chk=000177004.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000177004

0 1
 O   0.5737000       3.832500     -0.4923000    
 O  -0.8787000     -0.6149000       1.593900    
 O   -3.660300       2.955400      -2.382000    
 O   0.8656000      0.4406000      -1.582200    
 O    3.607100      0.8559000       3.764700    
 O   -4.863500      0.8093000      -1.668200    
 O    4.814600     -0.4341000       1.909200    
 O   -6.194500      -1.293700      -1.061300    
 O    6.150000      -1.752500      0.1653000    
 C  -0.5763000       1.818700      0.1646000    
 C   0.5555000       1.517700       1.023500    
 C   -1.703700      0.9936000      5.2200001E-02
 C    1.676800      0.7814000      0.6227000    
 C   -2.751900       1.354800     -0.7968000    
 C    2.715000      0.5462000       1.526600    
 C   -2.964100      -1.118800      0.7093000    
 C   -1.771900     -0.2560000      0.8370000    
 C    2.941300     -0.5149000      -1.167000    
 C   -4.012100     -0.7577000     -0.1399000    
 C    1.751800      0.2588000     -0.7569000    
 C    3.979400     -0.7504000     -0.2631000    
 C  -0.5058000       3.001200     -0.5749000    
 C   -3.944400      0.4923000     -0.9240000    
 C    3.904200     -0.2283000       1.116700    
 C   0.4769000       2.015600       2.324400    
 C   -2.675000       2.542000      -1.535100    
 C    2.631700       1.047100       2.831200    
 C   -1.551800       3.361800      -1.422100    
 C    1.512600       1.780500       3.226400    
 C   -3.040300      -2.306700       1.446400    
 C    3.025300      -1.014400      -2.472200    
 C   -5.136600      -1.584300     -0.2518000    
 C    5.101400      -1.485400     -0.6643000    
 C   -4.162300      -3.127800       1.331500    
 C    4.145400      -1.746100      -2.868000    
 C   -5.208300      -2.767300      0.4844000    
 C    5.181200      -1.981100      -1.966000    
 C   -4.242600      -4.393400       2.116700    
 C    4.234500      -2.277700      -4.258800    
 H  -0.3849000       2.589900       2.658100    
 H   -1.482200       4.286000      -1.991300    
 H    1.440800       2.172600       4.237500    
 H   -2.232000      -2.603400       2.110500    
 H    2.226600     -0.8381000      -3.188500    
 H   -6.083000      -3.407100      0.3920000    
 H    6.051900      -2.550800      -2.283300    
 H   -5.282800      -4.669000       2.321200    
 H   -3.767300      -5.209400       1.563300    
 H   -3.743600      -4.287500       3.086000    
 H    1.262100       3.481100      9.2100002E-02
 H    3.241700      -2.518400      -4.654000    
 H    4.703400      -1.537300      -4.914400    
 H    4.824100      -3.200100      -4.293400    
 H   -3.406900       3.800000      -2.791700    
 H    4.337400      0.3360000       3.397900    
 H   -6.052000     -0.4567000      -1.527300    
 H    6.819400      -2.273500     -0.3101000    


%chk=000177004-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000177004

0 1
O 0.602487 3.740908 -0.628142
O -0.873832 -0.721402 1.491526
O -3.819178 3.030825 -2.350056
O 0.992358 0.458182 -1.687837
O 3.701525 0.880694 3.782156
O -5.166254 0.900084 -1.575737
O 4.997344 -0.305266 2.028779
O -6.464034 -1.133645 -0.907260
O 6.392389 -1.663237 0.210758
C -0.602923 1.720649 0.096517
C 0.556267 1.413033 1.003099
C -1.796364 0.958701 0.016061
C 1.753214 0.766007 0.583991
C -2.908419 1.375964 -0.803154
C 2.827655 0.556944 1.510134
C -3.104630 -1.142137 0.705333
C -1.861437 -0.328175 0.786525
C 3.132079 -0.510825 -1.167484
C -4.194116 -0.696444 -0.097973
C 1.891110 0.254967 -0.807234
C 4.192974 -0.709103 -0.223345
C -0.527919 2.930682 -0.657554
C -4.132425 0.555123 -0.865157
C 4.062000 -0.162500 1.137939
C 0.480981 1.901665 2.344769
C -2.774431 2.594984 -1.542885
C 2.707542 1.043170 2.858142
C -1.591875 3.361620 -1.458854
C 1.523989 1.724071 3.256172
C -3.188304 -2.347431 1.426960
C 3.211587 -1.021953 -2.477302
C -5.380796 -1.504646 -0.153946
C 5.336118 -1.445880 -0.666892
C -4.363429 -3.150433 1.371690
C 4.345341 -1.753772 -2.909649
C -5.447245 -2.718738 0.581491
C 5.395867 -1.955012 -1.990145
C -4.436926 -4.447890 2.153407
C 4.423684 -2.297016 -4.321980
H -0.433938 2.412100 2.663411
H -1.478357 4.296479 -2.019352
H 1.459322 2.089412 4.284832
H -2.327156 -2.651907 2.030603
H 2.368714 -0.836287 -3.150488
H -6.367670 -3.306913 0.511973
H 6.284520 -2.520297 -2.303503
H -5.400677 -4.962011 2.003104
H -3.629028 -5.139194 1.849013
H -4.312165 -4.264853 3.237028
H 1.302122 3.328942 -0.054000
H 3.540998 -2.919792 -4.555258
H 4.439281 -1.473026 -5.059735
H 5.326814 -2.910010 -4.479526
H -3.568867 3.874823 -2.808356
H 4.469858 0.358762 3.291588
H -6.200998 -0.225186 -1.357834
H 7.107855 -2.189613 -0.231963


