%chk=000076204.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000076204

0 1
 O    3.413000       1.183600      0.1707000    
 O    5.400600       1.763300     -0.8356000    
 C   -3.309200       1.086900      0.4059000    
 C   -4.341500      0.1662000     -0.2540000    
 C   -1.907300      0.9533000     -0.1936000    
 C   -5.785000      0.3144000      0.2401000    
 C  -0.8732000       1.865000      0.4749000    
 C   -6.756300     -0.6718000     -0.4135000    
 C   0.5344000       1.714800     -0.1075000    
 C   -8.180300     -0.5819000      0.1448000    
 C    1.532100       2.626500      0.6146000    
 C   -9.147600      -1.584000     -0.4867000    
 C    2.937500       2.515100      3.6100000E-02
 C   -10.56050      -1.401500      4.7200002E-02
 C    4.665300      0.9430000     -0.3086000    
 C    5.042000     -0.4793000     -0.1096000    
 C    6.290000     -0.9361000     -0.5336000    
 C    4.148300      -1.358800      0.5017000    
 C    6.644200      -2.272200     -0.3466000    
 C    4.502700      -2.694900      0.6888000    
 C    5.750600      -3.151500      0.2646000    
 H   -3.269700      0.8674000       1.479800    
 H   -3.643800       2.126800      0.3072000    
 H   -4.022900     -0.8737000     -0.1064000    
 H   -4.327800      0.3416000      -1.337300    
 H   -1.577200     -8.9100003E-02 -0.1054000    
 H   -1.948900       1.182800      -1.265400    
 H   -5.801900      0.1687000       1.327200    
 H   -6.126800       1.339500      5.2900001E-02
 H  -0.8447000       1.643400       1.549000    
 H   -1.197600       2.908300      0.3753000    
 H   -6.382700      -1.693200     -0.2695000    
 H   -6.778700     -0.4926000      -1.495500    
 H   0.5162000       1.960500      -1.176000    
 H   0.8511000      0.6687000     -2.1000000E-02
 H   -8.152600     -0.7434000       1.229700    
 H   -8.558000      0.4361000     -1.3300000E-02
 H    1.198000       3.668400      0.5520000    
 H    1.558100       2.348800       1.675500    
 H   -9.155700      -1.456200      -1.575300    
 H   -8.809300      -2.606000     -0.2815000    
 H    2.928600       2.798100      -1.023200    
 H    3.604600       3.195600      0.5781000    
 H   -10.93790     -0.3983000     -0.1751000    
 H   -11.23630      -2.128400     -0.4142000    
 H   -10.59190      -1.548700       1.131500    
 H    7.000500     -0.2671000      -1.011800    
 H    3.166900      -1.046200      0.8469000    
 H    7.615800      -2.628000     -0.6768000    
 H    3.807300      -3.380200       1.164700    
 H    6.026400      -4.191800      0.4103000    


%chk=000076204-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000076204

0 1
O 3.449471 1.175813 0.201077
O 5.355629 1.705885 -1.030022
C -3.351303 1.033723 0.382861
C -4.399390 0.174164 -0.359228
C -1.946166 0.972294 -0.257409
C -5.802225 0.223094 0.287183
C -0.899425 1.839998 0.476862
C -6.850610 -0.631911 -0.460066
C 0.508384 1.757549 -0.154024
C -8.251956 -0.592218 0.190234
C 1.544741 2.643381 0.572369
C -9.299928 -1.445051 -0.561030
C 2.949381 2.565776 -0.025830
C -10.695610 -1.405300 0.098329
C 4.691740 0.873008 -0.361764
C 5.114809 -0.529052 -0.072417
C 6.353998 -0.973538 -0.602495
C 4.322081 -1.410265 0.708297
C 6.796824 -2.288786 -0.354166
C 4.769713 -2.725402 0.954687
C 6.005730 -3.167063 0.424958
H -3.286891 0.701009 1.440152
H -3.696297 2.088770 0.410248
H -4.049812 -0.879115 -0.395105
H -4.470197 0.513021 -1.414132
H -1.598605 -0.081914 -0.276965
H -2.011927 1.296350 -1.317175
H -5.732385 -0.121100 1.340461
H -6.150771 1.276535 0.327911
H -0.843344 1.525068 1.540054
H -1.240355 2.896974 0.483703
H -6.498685 -1.684055 -0.506649
H -6.924922 -0.283418 -1.511661
H 0.451716 2.060220 -1.220643
H 0.858802 0.706921 -0.143876
H -8.179886 -0.944553 1.240715
H -8.604952 0.459411 0.239793
H 1.221432 3.703978 0.531147
H 1.592609 2.367390 1.644100
H -9.374063 -1.089760 -1.609283
H -8.944123 -2.494470 -0.613832
H 2.956157 2.765345 -1.113527
H 3.654676 3.265309 0.459344
H -11.086486 -0.370753 0.136153
H -11.425692 -2.022147 -0.457573
H -10.653675 -1.784693 1.136933
H 6.947736 -0.274666 -1.201039
H 3.370117 -1.055154 1.112559
H 7.753514 -2.629954 -0.764171
H 4.158682 -3.405648 1.557998
H 6.350639 -4.189098 0.618453


