%chk=000150645.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000150645

0 1
 O   0.6446000     -0.1185000      0.6100000    
 O   0.8167000      -2.191300       1.524800    
 C   -4.428500     -0.4067000     -0.1609000    
 C   -3.405800      -1.445700      0.2892000    
 C   -5.687700     -0.5931000      0.7101000    
 C   -4.844900     -0.5655000      -1.637800    
 C   -3.939400       1.029500      2.4100000E-02
 C    4.090300      0.1325000     -0.5137000    
 C   -1.813300      -3.373000      7.6499999E-02
 C    5.249000     -0.7150000      2.0300001E-02
 C   -2.833100      -2.406100     -0.4544000    
 C  -0.5044000      -3.354000     -0.7232000    
 C    4.287400       1.635200     -0.2838000    
 C    5.030500      -2.219600     -0.1541000    
 C   -2.761100       1.446400      0.5175000    
 C   -2.398500       2.894200      0.6866000    
 C   0.1740000      -1.986900     -0.7953000    
 C    3.115100       2.455100     -0.7421000    
 C    6.146600      -3.064200      0.4419000    
 C   -1.162500       3.255700     -8.4200002E-02
 C    1.235200       4.079800     -0.3794000    
 C    2.414200       3.263400      6.6799998E-02
 C   1.4000000E-03   3.719700      0.3967000    
 C   0.5743000      -1.472100      0.5645000    
 H   -3.119100      -1.391500       1.340000    
 H   -6.102900      -1.602100      0.5983000    
 H   -6.476400      0.1181000      0.4356000    
 H   -5.468400     -0.4422000       1.774500    
 H   -5.609900      0.1691000      -1.919000    
 H   -3.994600     -0.4200000      -2.315200    
 H   -5.269600      -1.557500      -1.833000    
 H   -4.653500       1.797400     -0.2753000    
 H    3.960800     -6.3000001E-02  -1.585600    
 H    3.167800     -0.1889000     -2.0500001E-02
 H    6.175900     -0.4222000     -0.4880000    
 H    5.389800     -0.4964000       1.086100    
 H   -1.610700      -3.186200       1.137100    
 H   -2.239500      -4.382100      2.0199999E-02
 H   -3.090700      -2.518800      -1.502900    
 H   0.1838000      -4.085400     -0.2812000    
 H  -0.7034000      -3.695900      -1.746900    
 H    5.176800       1.970100     -0.8312000    
 H    4.488000       1.814400      0.7797000    
 H    4.937600      -2.451800      -1.221600    
 H    4.082800      -2.506600      0.3172000    
 H   -2.017800      0.7273000      0.8473000    
 H   -2.250600       3.090200       1.755400    
 H   -3.215400       3.547400      0.3574000    
 H    1.084900      -2.058400      -1.400100    
 H  -0.4878000      -1.257700      -1.274900    
 H    2.836500       2.371700      -1.789500    
 H    5.941800      -4.128300      0.2883000    
 H    7.106600      -2.829600     -2.8600000E-02
 H    6.238500      -2.886300       1.518000    
 H   -1.237800       3.124900      -1.163400    
 H    1.458600       5.139800     -0.2119000    
 H    1.058900       3.959900      -1.455100    
 H    2.706000       3.351500       1.111200    
 H   7.0799999E-02   3.866600       1.474200    
 H   0.9088000      0.2065000       1.496900    


%chk=000150645-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000150645

0 1
O 0.772109 0.261984 -1.098114
O 0.975923 -1.380956 0.534666
C -4.677525 -0.401555 0.086229
C -3.510004 -1.316700 0.439395
C -5.793614 -0.580675 1.168376
C -5.281002 -0.710698 -1.311755
C -4.233648 1.069061 0.105151
C 4.332262 -0.084269 -0.107161
C -1.773900 -3.142478 0.092503
C 5.565025 -0.841038 0.435579
C -2.983313 -2.320051 -0.308721
C -0.703329 -3.221772 -1.033825
C 4.339676 1.422685 0.266310
C 5.554342 -2.344725 0.076830
C -2.981086 1.535855 0.343074
C -2.577282 3.004279 0.375589
C -0.247817 -1.851889 -1.575422
C 3.223773 2.215385 -0.384729
C 6.785012 -3.103248 0.619133
C -1.249584 3.231689 -0.328035
C 1.234970 3.838404 -0.376998
C 2.311138 2.981046 0.276770
C -0.121257 3.668410 0.288437
C 0.544689 -1.015834 -0.584966
H -3.053392 -1.113580 1.422363
H -6.190244 -1.612172 1.145474
H -6.631173 0.119683 0.987280
H -5.396305 -0.382865 2.180266
H -6.115664 -0.018911 -1.529257
H -4.525123 -0.590131 -2.108169
H -5.676251 -1.742931 -1.352695
H -5.045305 1.790069 -0.094475
H 4.297190 -0.186374 -1.212243
H 3.410865 -0.556876 0.285844
H 6.491875 -0.375349 0.038082
H 5.608874 -0.730269 1.539318
H -1.315642 -2.721414 1.006046
H -2.082092 -4.181070 0.335108
H -3.423169 -2.559450 -1.289540
H 0.172257 -3.779999 -0.652816
H -1.114991 -3.801964 -1.883920
H 5.314421 1.853053 -0.050406
H 4.288182 1.533577 1.367288
H 5.507166 -2.454098 -1.026192
H 4.627405 -2.804657 0.474816
H -2.164789 0.825787 0.534866
H -2.481369 3.342084 1.428707
H -3.377427 3.617594 -0.086019
H 0.392471 -1.980950 -2.470891
H -1.112732 -1.247357 -1.906175
H 3.189124 2.182594 -1.486862
H 6.752130 -4.174874 0.348861
H 7.723545 -2.680515 0.212668
H 6.837311 -3.034999 1.722288
H -1.213978 2.967287 -1.395799
H 1.544592 4.903706 -0.294297
H 1.166939 3.610113 -1.457169
H 2.353573 3.020411 1.377340
H -0.161550 3.907543 1.363944
H 1.324416 0.828196 -0.478352


