%chk=000101767.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000101767

0 1
 O    6.062300     -0.1841000      0.6313000    
 O   -6.406900     -0.3676000      0.2699000    
 C   6.1799999E-02  0.9623000     -0.2461000    
 C    1.499200      0.9696000      0.2860000    
 C  -0.6418000     -0.3462000      0.2409000    
 C    2.327400     -0.2390000     -0.2019000    
 C   -2.145800     -0.4103000     -0.2188000    
 C   -2.850400      0.8811000      0.3096000    
 C    3.685100      0.1114000      0.4546000    
 C   0.1878000      -1.613000     -9.7800002E-02
 C    1.661600      -1.513300      0.3368000    
 C  -0.7103000       2.210900      0.2036000    
 C    2.396800       2.165500     -1.6799999E-02
 C   -2.182400       2.162800     -0.1998000    
 C    3.822500       1.634200      0.2209000    
 C   -2.862900      -1.634000      0.4200000    
 C    2.461700     -0.3340000      -1.742600    
 C   -4.360100      0.8908000      3.8699999E-02
 C   -2.245200     -0.5366000      -1.760700    
 C    4.897500     -0.6731000     -2.5900001E-02
 C   -4.377200      -1.638400      0.1998000    
 C   -5.034700     -0.3375000      0.6483000    
 C    4.754000      -2.161800      0.2499000    
 H   9.0899996E-02  0.9807000      -1.340000    
 H    1.425700      0.9182000       1.385600    
 H  -0.6575000     -0.2974000       1.341600    
 H   -2.739200      0.8889000       1.405500    
 H    3.601900     -2.5800001E-02   1.544000    
 H   0.1457000      -1.821500      -1.171200    
 H  -0.2460000      -2.485800      0.4028000    
 H    1.705700      -1.528300       1.433300    
 H    2.158100      -2.421300     -8.8999998E-03
 H  -0.2558000       3.110500     -0.2275000    
 H  -0.6420000       2.316000       1.294000    
 H    2.177400       3.017800      0.6344000    
 H    2.282000       2.502000      -1.053200    
 H   -2.689900       3.039300      0.2216000    
 H   -2.276000       2.245500      -1.288500    
 H    4.452100       1.864200     -0.6463000    
 H    4.279100       2.116300       1.092600    
 H   -2.669400      -1.646800       1.500800    
 H   -2.458200      -2.571100      2.0300001E-02
 H    3.010000      -1.235100      -2.036900    
 H    1.493800     -0.3858000      -2.248000    
 H    2.993800      0.5220000      -2.169500    
 H   -4.815600       1.791700      0.4703000    
 H   -4.572000      0.9537000      -1.035300    
 H   -1.838900      -1.492600      -2.107200    
 H   -3.278500     -0.4948000      -2.116500    
 H   -1.705200      0.2551000      -2.285500    
 H    5.074100     -0.5210000      -1.095400    
 H   -4.607900      -1.835100     -0.8543000    
 H   -4.824700      -2.477600      0.7474000    
 H   -4.998500     -0.2689000       1.741700    
 H    4.133800      -2.660600     -0.4964000    
 H    5.737800      -2.644900      0.2139000    
 H    4.356600      -2.354400       1.251900    
 H    5.953900     -0.3382000       1.585400    
 H   -6.450600     -0.4115000     -0.7005000    


%chk=000101767-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000101767

0 1
O 6.172770 -0.077202 0.700854
O -6.550733 -0.333479 0.511936
C 0.044314 0.958159 -0.291855
C 1.489443 0.948588 0.250929
C -0.681380 -0.342859 0.189356
C 2.339733 -0.287557 -0.200105
C -2.190640 -0.401294 -0.268460
C -2.890499 0.900355 0.271949
C 3.709420 0.065652 0.489375
C 0.139771 -1.612955 -0.169597
C 1.612500 -1.554528 0.319912
C -0.721989 2.226123 0.159361
C 2.410244 2.159119 -0.029668
C -2.212040 2.188453 -0.244240
C 3.842820 1.620929 0.293947
C -2.900244 -1.622496 0.400608
C 2.521242 -0.355943 -1.741424
C -4.422322 0.901288 0.042868
C -2.302015 -0.524849 -1.813637
C 4.985246 -0.676022 0.030870
C -4.438015 -1.634796 0.209231
C -5.083967 -0.325301 0.700676
C 4.980873 -2.198298 0.259691
H 0.082814 0.963216 -1.401807
H 1.402727 0.863686 1.360625
H -0.704686 -0.282658 1.304570
H -2.736783 0.883111 1.376979
H 3.581977 -0.144480 1.577168
H 0.127763 -1.771468 -1.265408
H -0.339534 -2.504236 0.277503
H 1.625318 -1.544523 1.430926
H 2.131888 -2.478917 0.002817
H -0.234243 3.126226 -0.261893
H -0.649510 2.312783 1.265261
H 2.147121 3.037617 0.585767
H 2.330870 2.472043 -1.088945
H -2.737765 3.072419 0.169226
H -2.309349 2.254695 -1.346807
H 4.556544 1.840051 -0.520959
H 4.260863 2.095351 1.198332
H -2.675255 -1.608524 1.488684
H -2.484833 -2.568598 0.004466
H 3.084969 -1.263635 -2.027436
H 1.554984 -0.394904 -2.272554
H 3.075902 0.517337 -2.128522
H -4.864437 1.823097 0.467662
H -4.655238 0.909027 -1.043359
H -1.919166 -1.503512 -2.155761
H -3.348256 -0.448225 -2.156409
H -1.729605 0.259117 -2.338644
H 5.182063 -0.457547 -1.034085
H -4.685680 -1.778712 -0.863469
H -4.883429 -2.487811 0.754831
H -4.977963 -0.251165 1.799336
H 4.259803 -2.708662 -0.403085
H 5.986483 -2.604474 0.053475
H 4.710446 -2.444192 1.305098
H 6.060533 -0.196411 1.679662
H -6.735366 -0.405106 -0.459920


