%chk=000079535.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000079535

0 1
 O   -1.399700      -2.336700      4.4999998E-03
 C   -1.671700      0.5193000     -2.4999999E-03
 C   -2.485500      0.2093000       1.266200    
 C   -2.485500      0.2036000      -1.269700    
 C   -3.829000      0.9368000       1.259200    
 C   -3.829100      0.9311000      -1.266100    
 C   -4.629600      0.6287000     -2.7000001E-03
 C  -0.3304000     -0.1913000     -3.0000001E-04
 C    3.335300      0.7335000     -2.3000001E-03
 C   0.8405000      0.5650000     -1.6000000E-03
 C    2.080900     -7.2899997E-02 -1.2000001E-03
 C  -0.2645000      -1.583600      1.3000000E-03
 C    2.148800      -1.466000      3.9999999E-04
 C   0.9762000      -2.221400      1.5000000E-03
 C    4.492200     -2.0600000E-02 -0.7285000    
 C    3.813000       1.039100       1.451300    
 C    3.237900       2.126100     -0.7095000    
 H   -1.485800       1.603100     -5.1000002E-03
 H   -1.917800      0.5112000       2.155400    
 H   -2.682400     -0.8618000       1.377500    
 H   -2.682400     -0.8679000      -1.376300    
 H   -1.917800      0.5015000      -2.160300    
 H   -3.658500       2.018200       1.328500    
 H   -4.408700      0.6486000       2.143400    
 H   -4.408900      0.6390000      -2.148900    
 H   -3.658700       2.012200      -1.340400    
 H   -4.921000     -0.4288000     -3.0000001E-04
 H   -5.555200       1.215200     -4.0000002E-03
 H   0.7648000       1.647400      1.3000000E-02
 H    3.085700      -2.011000      2.5000000E-02
 H    1.043100      -3.306100      8.2000000E-03
 H    5.368900      0.6282000     -0.8473000    
 H    4.844200     -0.8924000     -0.1665000    
 H    4.190700     -0.3467000      -1.730900    
 H    3.983200      0.1121000       2.011300    
 H    4.749200       1.608700       1.453800    
 H    3.061000       1.619200       1.998700    
 H    4.217500       2.615200     -0.7669000    
 H    2.858400       2.017500      -1.732100    
 H    2.575900       2.814400     -0.1728000    
 H   -1.156400      -3.278300      5.4000001E-03


%chk=000079535-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000079535

0 1
O -1.430586 -2.428239 -0.267667
C -1.682234 0.469831 0.052581
C -2.462249 0.058409 1.336612
C -2.582483 0.307332 -1.207803
C -3.781003 0.856185 1.474035
C -3.902466 1.102751 -1.061027
C -4.670662 0.693838 0.218354
C -0.344382 -0.255872 -0.069660
C 3.421464 0.770033 -0.038978
C 0.866265 0.473727 -0.019588
C 2.156491 -0.118220 -0.108575
C -0.236836 -1.668255 -0.219500
C 2.209958 -1.523985 -0.258718
C 1.025103 -2.291110 -0.314018
C 4.727562 -0.059513 -0.141145
C 3.442437 1.541295 1.315377
C 3.402574 1.794303 -1.213859
H -1.453162 1.554063 0.147679
H -1.821209 0.221280 2.225069
H -2.685442 -1.023859 1.287629
H -2.807273 -0.765965 -1.350150
H -2.027836 0.647549 -2.104286
H -3.548427 1.932918 1.616105
H -4.328674 0.525359 2.378349
H -4.536236 0.945561 -1.955932
H -3.676093 2.189180 -1.015949
H -4.985882 -0.366439 0.130305
H -5.593647 1.297949 0.320636
H 0.785142 1.562170 0.097995
H 3.171399 -2.039850 -0.333152
H 1.088992 -3.382341 -0.429176
H 5.600999 0.614817 -0.073649
H 4.808737 -0.795707 0.680153
H 4.795787 -0.599978 -1.103551
H 3.480695 0.837016 2.166793
H 4.330084 2.200033 1.368588
H 2.543826 2.171659 1.439787
H 4.296265 2.445652 -1.170540
H 3.399787 1.272244 -2.188426
H 2.508270 2.442120 -1.176117
H -1.216253 -3.389240 -0.366183


