%chk=000001441.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000001441

0 1
 O   -4.752700     -9.3999999E-03   2.516500    
 O   -5.579600      2.0800000E-02  -1.582400    
 O  -6.4800002E-02   2.928800     -0.6382000    
 O    4.986500      -3.585200       1.083900    
 O    3.988400      -1.569900       1.384900    
 C   -2.983900      9.7400002E-02  0.8484000    
 C   -3.705000     -0.7345000     -0.2357000    
 C   -4.127700      0.8412000       1.557500    
 C   -5.122400       1.220900      0.4593000    
 C   -4.885100      0.1528000     -0.5820000    
 C   -2.875300      -1.127100      -1.445500    
 C   -1.966500       1.071100      0.3312000    
 C   -1.713900      -2.055000      -1.205200    
 C  -0.6774000       1.049900      0.6927000    
 C  -0.4255000      -1.831500      -1.505700    
 C   0.2832000       2.050000      0.1474000    
 C    1.719000       1.938700      0.6203000    
 C   0.6765000      -2.809900      -1.220500    
 C    2.711600       2.499200     -0.3950000    
 C    1.760500      -2.261300     -0.2824000    
 C    4.164600       2.373400      7.1400002E-02
 C    5.132800       2.915300     -0.9807000    
 C    2.898700      -3.247600     -3.4000000E-03
 C    6.579100       2.764500     -0.5365000    
 C    3.978900      -2.692600      0.8993000    
 H   -2.503100     -0.5983000       1.549300    
 H   -4.127600      -1.634300      0.2324000    
 H   -3.779900       1.727600       2.099800    
 H   -6.160800       1.192700      0.7982000    
 H   -4.875900       2.189700      1.5500000E-02
 H   -2.536100     -0.2325000      -1.983900    
 H   -3.535300      -1.639200      -2.159700    
 H   -2.318500       1.823000     -0.3713000    
 H   -5.486300      0.4897000       2.914500    
 H   -1.975400      -3.001100     -0.7343000    
 H  -0.2964000      0.3137000       1.391700    
 H  -0.1450000     -0.8964000      -1.983400    
 H    1.953900      0.8845000      0.8063000    
 H    1.800900       2.479100       1.570000    
 H    1.138000      -3.088000      -2.175900    
 H   0.2699000      -3.734300     -0.7919000    
 H    2.585400       1.974700      -1.350800    
 H    2.485400       3.555500     -0.5877000    
 H    4.297000       2.919500       1.013200    
 H    4.393100       1.319800      0.2730000    
 H    2.180700      -1.342700     -0.7132000    
 H    1.300700      -1.966200      0.6700000    
 H    4.922000       3.974200      -1.170400    
 H    4.991500       2.381300      -1.927500    
 H    3.368700      -3.533200     -0.9513000    
 H    2.492000      -4.146800      0.4727000    
 H    6.762900       3.312500      0.3931000    
 H    7.254000       3.158900      -1.302600    
 H    6.830900       1.712100     -0.3710000    
 H    5.697400      -3.221000       1.653300    


%chk=000001441-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000001441

0 1
O -4.549128 0.098544 2.583908
O -5.804368 0.036932 -1.403186
O 0.151596 2.511563 -1.243460
O 4.898972 -3.360199 0.869084
O 3.858050 -1.294671 0.700449
C -2.897603 0.088392 0.829971
C -3.805189 -0.736425 -0.144694
C -3.935980 0.989062 1.578444
C -4.953612 1.399683 0.493333
C -4.974828 0.209324 -0.480259
C -3.153449 -1.367897 -1.401133
C -1.855993 0.928941 0.132782
C -2.077690 -2.376070 -1.055649
C -0.537023 0.951608 0.470339
C -0.800372 -2.310351 -1.511868
C 0.469298 1.800089 -0.242456
C 1.890123 1.750752 0.313554
C 0.331315 -3.244759 -1.139749
C 2.919394 2.576279 -0.476553
C 1.473350 -2.459981 -0.441582
C 4.325440 2.520463 0.161231
C 5.384054 3.308011 -0.643706
C 2.701661 -3.330151 -0.121205
C 6.783045 3.277498 0.008954
C 3.827499 -2.531786 0.507439
H -2.410125 -0.566419 1.571937
H -4.255370 -1.548940 0.465636
H -3.456055 1.856171 2.071722
H -5.964878 1.626792 0.873621
H -4.606258 2.295294 -0.059959
H -2.727258 -0.575466 -2.044835
H -3.970987 -1.840099 -1.982479
H -2.170628 1.579256 -0.699943
H -5.244273 0.597339 3.082774
H -2.369850 -3.196477 -0.379298
H -0.165063 0.324182 1.293046
H -0.525478 -1.476781 -2.178667
H 2.214644 0.689740 0.378142
H 1.845905 2.095037 1.371025
H 0.737570 -3.733186 -2.051029
H -0.039253 -4.052594 -0.478505
H 2.963627 2.200312 -1.517528
H 2.573570 3.625508 -0.551202
H 4.279595 2.927257 1.194128
H 4.644066 1.461941 0.258732
H 1.784466 -1.615933 -1.086703
H 1.084911 -2.007514 0.489952
H 5.049649 4.359842 -0.755249
H 5.443226 2.891898 -1.670236
H 3.100322 -3.810168 -1.037329
H 2.445862 -4.162383 0.562796
H 6.756072 3.720716 1.022655
H 7.522846 3.842842 -0.587553
H 7.150683 2.238443 0.108428
H 5.624004 -2.806964 1.269634


