%chk=000127261.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000127261

0 1
 O   -5.351400     -0.7814000      0.1596000    
 O   -1.836400      -3.915800      0.8273000    
 O   0.4420000      -3.295000     -0.3954000    
 O    7.028700     -8.2099997E-02  0.5808000    
 O    6.447200       2.590300      8.4899999E-02
 C   -3.114600     -0.2040000     -0.4791000    
 C   -3.570100       1.151700     -0.9582000    
 C   -1.770300     -0.5316000     -0.5838000    
 C   -1.332800      -1.781200     -0.1450000    
 C   -4.030500      -1.098800      5.4699998E-02
 C   -3.516400       2.189600      0.1272000    
 C   -2.244200      -2.689700      0.3937000    
 C   -3.592900      -2.348500      0.4933000    
 C   -4.310200       3.266500      0.2823000    
 C   7.9499997E-02  -2.117900     -0.2581000    
 C    1.090500      -1.010200     -0.1734000    
 C   -4.203100       4.270200       1.395100    
 C   -5.407200       3.553100     -0.7083000    
 C    3.468000     -0.2638000     -0.1576000    
 C    2.402600      -1.277900     -0.2451000    
 C    4.754400     -0.6579000      0.1730000    
 C    3.162500       1.064300     -0.4072000    
 C    5.762800      0.3022000      0.2559000    
 C    4.170800       2.024500     -0.3241000    
 C    5.471000       1.643300      7.4000000E-03
 H   -2.899700       1.478400      -1.765100    
 H   -4.552800       1.067200      -1.432000    
 H   -1.094800      0.1839000      -1.043100    
 H   -2.723900       2.059100      0.8643000    
 H   -4.309300      -3.051200      0.9120000    
 H   0.7298000     -9.4999997E-03  2.5599999E-02
 H   -3.404300       4.009400       2.097100    
 H   -3.984600       5.265100      0.9944000    
 H   -5.140900       4.316200       1.958000    
 H   -5.308800       3.016500      -1.654600    
 H   -6.380500       3.308100     -0.2709000    
 H   -5.409300       4.618600     -0.9653000    
 H    2.745300      -2.300100     -0.3872000    
 H   -5.478100      0.1793000      0.1189000    
 H    4.983100      -1.702800      0.3686000    
 H    2.171500       1.403800     -0.6916000    
 H   -2.605300      -4.404900       1.167100    
 H    3.931300       3.065400     -0.5253000    
 H    7.042900      -1.045000      0.7173000    
 H    6.061700       3.459900     -0.1180000    


%chk=000127261-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000127261

0 1
O -5.187629 -0.237375 0.600670
O -1.786371 -3.631766 1.121945
O 0.519614 -3.154713 -0.455722
O 7.499901 -0.614815 -0.963045
O 7.400021 1.886459 0.056123
C -2.882536 0.283674 -0.132404
C -3.286334 1.657662 -0.665670
C -1.560865 -0.191746 -0.241445
C -1.156643 -1.500790 0.138474
C -3.847463 -0.601553 0.435743
C -4.151715 2.465846 0.295170
C -2.160396 -2.357516 0.688637
C -3.488031 -1.901776 0.841699
C -5.303021 3.154150 0.015758
C 0.250075 -1.957420 -0.114762
C 1.330560 -0.936758 0.031798
C -6.005341 3.958252 1.098042
C -5.970247 3.205174 -1.347783
C 3.810527 -0.390872 -0.179691
C 2.625422 -1.243029 -0.297656
C 5.066227 -0.904313 -0.620030
C 3.781516 0.927720 0.355141
C 6.249528 -0.146346 -0.540478
C 4.959510 1.691326 0.439299
C 6.199791 1.172074 -0.003885
H -2.361848 2.230470 -0.878081
H -3.803097 1.540649 -1.638412
H -0.812537 0.469951 -0.694363
H -3.754323 2.528970 1.319964
H -4.262012 -2.539905 1.284170
H 1.061322 0.041086 0.447652
H -5.493013 3.876607 2.071744
H -6.048935 5.030288 0.821609
H -7.053195 3.623621 1.227710
H -5.501307 2.542341 -2.092212
H -7.040404 2.932336 -1.269513
H -5.937520 4.237525 -1.748563
H 2.780447 -2.258723 -0.693324
H -5.282143 0.754710 0.486544
H 5.106588 -1.921927 -1.032679
H 2.839893 1.355980 0.711598
H -2.566955 -4.110636 1.499512
H 4.924721 2.706596 0.856158
H 7.422635 -1.538690 -1.309930
H 7.248784 2.784503 0.444589


