%chk=000153910.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000153910

0 1
 O  -0.8796000       1.833100      0.3573000    
 O    4.372700      -1.553900       1.574600    
 O    3.298000      0.5199000      -2.606800    
 O   -3.483400       2.679300     -6.0300000E-02
 O  -0.2611000     -0.8586000      0.1411000    
 O    4.685400      -1.401300      -1.173700    
 C  -0.2060000       1.657200       1.601300    
 C    1.225500       2.197400       1.501100    
 C    2.148400       1.237800      0.7880000    
 C  -0.9967000       2.382900       2.682600    
 C   -1.852200      0.9291000      4.7100000E-02
 C    2.303400       1.317700     -0.5959000    
 C    2.845500      0.2716000       1.513200    
 C    3.697700     -0.6148000      0.8544000    
 C    3.155600      0.4314000      -1.254700    
 C   -3.162300       1.359100     -0.1625000    
 C   -1.536900     -0.4254000     -6.1000001E-02
 C   -3.842200     -0.9200000     -0.5882000    
 C    3.852700     -0.5347000     -0.5295000    
 C   -4.157400      0.4346000     -0.4803000    
 C   -2.531900      -1.349900     -0.3786000    
 C   -4.906000      -1.908300     -0.9283000    
 C   -5.599100      -2.470100      0.2861000    
 C   -3.387000       3.463400      -1.247600    
 C  -2.4000000E-02  -2.258900      1.1400000E-02
 C    4.157500      -1.567500       2.984500    
 C    2.549600       1.535500      -3.272000    
 C    4.115500      -2.624300      -1.634300    
 C   -5.581800      -3.762500      0.6311000    
 H  -0.1622000      0.6091000       1.917300    
 H    1.633200       2.389400       2.502000    
 H    1.233500       3.162700      0.9783000    
 H  -0.5070000       2.300600       3.658000    
 H   -2.007500       1.971400       2.773700    
 H   -1.109200       3.444700       2.436500    
 H    1.734400       2.087500      -1.106200    
 H    2.681700      0.2554000       2.585400    
 H   -5.177400      0.7758000     -0.6406000    
 H   -2.346700      -2.414500     -0.4747000    
 H   -5.661300      -1.434900      -1.569300    
 H   -4.479600      -2.714000      -1.540600    
 H   -6.159600      -1.775500      0.9072000    
 H   -3.666900       4.491600      -1.002700    
 H   -4.072900       3.086400      -2.012800    
 H   -2.360800       3.461400      -1.628500    
 H  -0.5770000      -2.833400      0.7623000    
 H  -0.2166000      -2.608000      -1.008700    
 H    1.040200      -2.425800      0.2069000    
 H    4.772100      -2.375000       3.395900    
 H    3.116900      -1.803800       3.231700    
 H    4.498500     -0.6386000       3.454300    
 H    1.470900       1.373200      -3.171700    
 H    2.853400       2.537500      -2.950400    
 H    2.783400       1.460600      -4.339300    
 H    3.728600      -3.209400     -0.7939000    
 H    3.315000      -2.429600      -2.355100    
 H    4.899700      -3.202400      -2.130700    
 H   -6.109300      -4.102100       1.515700    
 H   -5.044400      -4.498700      4.3600000E-02


%chk=000153910-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000153910

0 1
O -0.874326 1.323142 0.393512
O 5.903171 0.212390 1.439517
O 2.976963 -0.784206 -2.209204
O -3.249622 2.933716 0.241263
O -1.041896 -1.391010 -0.150472
O 5.521517 -0.743359 -1.057991
C -0.288747 0.920498 1.732859
C 1.083674 1.619023 1.800441
C 2.225920 0.946036 1.045021
C -1.229938 1.363630 2.861341
C -2.110286 0.741330 0.045114
C 2.020343 0.384243 -0.234905
C 3.515590 0.906701 1.624942
C 4.598031 0.308422 0.931730
C 3.099182 -0.209468 -0.929213
C -3.264714 1.561212 -0.073588
C -2.236595 -0.651647 -0.243873
C -4.636690 -0.383427 -0.681782
C 4.404040 -0.254758 -0.361582
C -4.513045 0.998724 -0.432433
C -3.486780 -1.208534 -0.591290
C -5.982966 -0.985358 -1.092214
C -6.312703 -2.286633 -0.384080
C -2.305201 3.778842 -0.522066
C -1.121455 -2.836746 -0.382343
C 6.162317 0.836687 2.736127
C 1.680993 -0.644314 -2.879788
C 5.500521 -2.182054 -1.386915
C -6.602839 -3.458094 -1.004678
H -0.171900 -0.179316 1.719125
H 1.363419 1.711503 2.867413
H 0.933695 2.653745 1.427992
H -0.848816 1.002409 3.834483
H -2.244356 0.951883 2.719347
H -1.309725 2.464607 2.897472
H 1.017068 0.414833 -0.664438
H 3.666626 1.334804 2.621174
H -5.376977 1.668149 -0.496838
H -3.587581 -2.279337 -0.793220
H -6.778119 -0.242644 -0.880987
H -5.998542 -1.159855 -2.186949
H -6.312998 -2.242469 0.715811
H -2.421039 4.789850 -0.102292
H -2.583800 3.783913 -1.593930
H -1.269610 3.421322 -0.399739
H -1.793643 -3.324113 0.349702
H -1.470503 -3.060536 -1.409025
H -0.093210 -3.203604 -0.248247
H 7.234128 0.672513 2.922056
H 5.568294 0.363560 3.543595
H 5.950237 1.923831 2.712455
H 0.871926 -1.140045 -2.309549
H 1.420948 0.421785 -3.024039
H 1.810995 -1.133013 -3.857117
H 5.439452 -2.790184 -0.463196
H 4.655524 -2.418606 -2.057104
H 6.457845 -2.373998 -1.895738
H -6.851907 -4.362861 -0.438840
H -6.608887 -3.541710 -2.099130


