%chk=000107171.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000107171

0 1
 O   -4.283100      -2.263300      0.7479000    
 C   -1.974000      0.2143000     -0.9393000    
 C   -1.032800       1.392700     -0.4888000    
 C   -2.587200     -0.6635000      0.2258000    
 C   -1.734900       2.181100      0.6525000    
 C   -3.179000      0.2610000       1.318500    
 C   -1.322700     -0.5814000      -2.085600    
 C   -2.191700       1.308500       1.810800    
 C   0.3790000      0.8866000     -0.1683000    
 C   9.8800004E-02  -1.061000      -1.813800    
 C  -0.8521000       2.410000      -1.652900    
 C   -3.759500      -1.515000     -0.3243000    
 C   -1.607300      -1.645100      0.8970000    
 C   0.9000000     -0.2438000     -0.8340000    
 C    1.221700       1.569300      0.7303000    
 C    2.215200     -0.6699000     -0.5684000    
 C    3.021300      1.2700000E-02  0.3369000    
 C    2.524100       1.134000      0.9851000    
 C    4.411400     -0.4540000      0.6042000    
 C    5.301200     -0.4072000     -0.6529000    
 C    4.451600      -1.866100       1.219300    
 H   -2.852100      0.7005000      -1.395400    
 H   -2.625500       2.678800      0.2412000    
 H   -1.112000       2.996800       1.034300    
 H   -3.517400     -0.3163000       2.187800    
 H   -4.067700      0.7748000      0.9272000    
 H   -1.294100      6.3199997E-02  -2.974300    
 H   -1.939200      -1.429900      -2.398100    
 H   -1.336300      0.8400000       2.308200    
 H   -2.683200       1.937700       2.562300    
 H   0.6390000      -1.097700      -2.768800    
 H   6.0300000E-02  -2.093200      -1.446900    
 H  -0.2910000       1.993400      -2.496500    
 H   -1.821000       2.752300      -2.034000    
 H  -0.2995000       3.297200      -1.318900    
 H   -3.425400      -2.227700      -1.082600    
 H   -4.552800     -0.9005000     -0.7643000    
 H   -1.311900      -2.449900      0.2183000    
 H  -0.7041000      -1.151900       1.260300    
 H   -2.051700      -2.128700       1.775500    
 H   0.8902000       2.465000       1.245700    
 H    2.595200      -1.549900      -1.083600    
 H    3.136400       1.691100       1.689500    
 H   -4.930600      -1.708500       1.214600    
 H    4.876000      0.2180000       1.338800    
 H    4.961900      -1.109800      -1.421600    
 H    6.335700     -0.6638000     -0.4003000    
 H    5.301400      0.5966000      -1.092100    
 H    3.841100      -1.911900       2.128000    
 H    5.477700      -2.138100       1.489400    
 H    4.076900      -2.625900      0.5250000    


%chk=000107171-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000107171

0 1
O -4.506718 -2.250863 0.726254
C -2.016496 0.212851 -0.925455
C -1.063549 1.400763 -0.523462
C -2.566276 -0.668748 0.267036
C -1.737418 2.220454 0.615511
C -3.140696 0.266411 1.377611
C -1.384658 -0.582930 -2.103828
C -2.151394 1.362589 1.823928
C 0.345789 0.883281 -0.168083
C 0.087728 -1.033441 -1.887349
C -0.900130 2.374552 -1.736900
C -3.754915 -1.510927 -0.301258
C -1.549947 -1.651882 0.903791
C 0.891822 -0.233170 -0.864917
C 1.169269 1.540180 0.781397
C 2.215915 -0.652145 -0.587932
C 3.038220 0.000773 0.360566
C 2.487428 1.111449 1.044910
C 4.465556 -0.474098 0.647344
C 5.368581 -0.377551 -0.611335
C 4.484263 -1.913342 1.229006
H -2.924438 0.710511 -1.340578
H -2.648483 2.691543 0.189092
H -1.085724 3.057777 0.929002
H -3.433281 -0.346886 2.253280
H -4.062240 0.761783 0.996242
H -1.430141 0.063526 -2.999668
H -1.999259 -1.467600 -2.352434
H -1.258278 0.905080 2.290657
H -2.624667 1.999681 2.596457
H 0.616761 -1.004531 -2.861723
H 0.114581 -2.095754 -1.576021
H -0.316670 1.928365 -2.559943
H -1.889480 2.678487 -2.132005
H -0.364546 3.286574 -1.413309
H -3.387655 -2.306844 -0.970116
H -4.439780 -0.848486 -0.877145
H -1.128907 -2.344086 0.154383
H -0.709527 -1.133531 1.392871
H -2.075769 -2.267581 1.656572
H 0.781246 2.402630 1.332957
H 2.608197 -1.522720 -1.131933
H 3.094141 1.642186 1.789634
H -4.998865 -1.603937 1.291422
H 4.890865 0.202422 1.416492
H 4.998979 -1.039654 -1.416654
H 6.404494 -0.683175 -0.371905
H 5.392500 0.653916 -1.006762
H 3.871587 -1.980662 2.146067
H 5.517470 -2.221117 1.477153
H 4.080815 -2.640522 0.499777


