%chk=000100157.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000100157

0 1
 O  -0.7132000      -1.049900      0.4293000    
 O   -4.766900       1.217300      1.2000001E-03
 O    2.584200      -2.485000     -0.3107000    
 O   -5.907300     -0.9434000      -1.400000    
 O    1.463000       2.314100     -0.4234000    
 O   -8.564800     -0.5261000     -0.4686000    
 O    6.097600       1.657400      0.6618000    
 O    6.995900     -0.7969000     -0.2788000    
 C   -4.967900     -8.2900003E-02  0.6141000    
 C    1.437900      7.7399999E-02  0.5486000    
 C   0.6272000      -1.064500     -7.0299998E-02
 C   -3.691800     -0.9174000      0.4300000    
 C   -2.718100      0.1793000      0.2243000    
 C   -6.188600     -0.7391000     -1.0100000E-02
 C   -1.335800      0.1476000      0.1923000    
 C  -0.6519000       1.344600     -7.3200002E-02
 C   -3.402600       1.356500     -4.0399998E-02
 C   0.8313000       1.340300     -3.6400001E-02
 C    2.914800     -0.1409000      0.3235000    
 C    1.287500      -2.386600      0.2815000    
 C   -7.445500      0.1381000      0.1074000    
 C    3.392200      -1.396600     -8.9500003E-02
 C   -1.353300       2.532100     -0.3479000    
 C   -2.749500       2.537900     -0.3393000    
 C   -6.447000      -2.111400      0.6221000    
 C    3.851700      0.8662000      0.6016000    
 C    4.757700      -1.604500     -0.3097000    
 C    5.216500      0.6524000      0.3971000    
 C    5.668100     -0.5784000     -6.9799997E-02
 C    6.405100       2.548300     -0.4086000    
 C    7.373600      -2.086100     -0.7582000    
 H   -5.143100      9.7499996E-02   1.684800    
 H    1.271800      0.1185000       1.634900    
 H   0.6014000     -0.9806000      -1.168700    
 H   -3.704200      -1.561100     -0.4548000    
 H   -3.475700      -1.518000       1.318500    
 H    1.361000      -2.533700       1.367100    
 H   0.6835000      -3.218800     -9.7599998E-02
 H   -7.675300      0.3570000       1.155500    
 H   -7.320100       1.081800     -0.4338000    
 H  -0.8255000       3.458000     -0.5601000    
 H   -3.300000       3.448100     -0.5504000    
 H   -5.594200      -2.786100      0.4915000    
 H   -6.660200      -2.025900       1.692600    
 H   -7.290500      -2.619500      0.1410000    
 H    3.523300       1.828500      0.9871000    
 H   -5.734600     -7.3399998E-02  -1.799200    
 H    5.046700      -2.593300     -0.6510000    
 H   -9.330500      6.4300001E-02 -0.3660000    
 H    6.857000       2.005100      -1.244600    
 H    7.122700       3.288000     -4.3299999E-02
 H    5.503300       3.070700     -0.7433000    
 H    6.945700      -2.291800      -1.745400    
 H    7.141200      -2.870900     -3.0400001E-02
 H    8.461800      -2.078200     -0.8796000    


%chk=000100157-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000100157

0 1
O -0.778321 -1.074631 0.420747
O -4.910718 1.222570 0.232079
O 2.587011 -2.503812 -0.269279
O -6.167592 -0.699408 -1.409538
O 1.405284 2.462596 -0.316474
O -8.774065 -0.274954 -0.502453
O 6.080848 1.862295 0.483713
O 7.086779 -0.643040 -0.351966
C -5.161441 -0.181550 0.781868
C 1.413531 0.118143 0.517635
C 0.622239 -1.068867 -0.068405
C -3.830713 -0.957394 0.557730
C -2.830802 0.163759 0.351493
C -6.406925 -0.730250 0.058785
C -1.432982 0.153628 0.253301
C -0.727323 1.371149 -0.023838
C -3.518759 1.375727 0.136590
C 0.758964 1.423620 -0.001204
C 2.905778 -0.081809 0.273337
C 1.254566 -2.398332 0.344843
C -7.657766 0.151562 0.338804
C 3.409191 -1.357091 -0.093529
C -1.472959 2.564320 -0.245483
C -2.876772 2.593052 -0.174983
C -6.666200 -2.199515 0.418138
C 3.847385 0.966401 0.430897
C 4.783954 -1.574196 -0.326216
C 5.223419 0.777540 0.214616
C 5.701384 -0.514251 -0.173544
C 6.924192 2.327797 -0.637138
C 7.603886 -1.975479 -0.675727
H -5.372916 -0.045160 1.859912
H 1.218786 0.121236 1.615613
H 0.599585 -1.000414 -1.176255
H -3.895580 -1.594660 -0.344668
H -3.587283 -1.604271 1.416014
H 1.337349 -2.462234 1.448226
H 0.680774 -3.256167 -0.037803
H -8.001462 0.027756 1.380400
H -7.406872 1.218247 0.163852
H -0.902581 3.475331 -0.454667
H -3.448492 3.509425 -0.337928
H -5.868000 -2.847395 0.020637
H -6.724852 -2.331964 1.513920
H -7.627904 -2.515038 -0.018959
H 3.511577 1.968773 0.702816
H -5.797196 0.199605 -1.624513
H 5.101601 -2.583208 -0.600128
H -8.400108 -0.399851 -1.416489
H 7.612002 1.532227 -0.970454
H 7.491271 3.180461 -0.233234
H 6.290735 2.664453 -1.480964
H 7.203397 -2.339390 -1.641775
H 7.362563 -2.701204 0.124466
H 8.694134 -1.850135 -0.748116


