%chk=000125312.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000125312

0 1
 O  -0.2760000       2.770200      -2.291500    
 O   0.2773000      -2.237000      -1.293000    
 O    6.205300     -0.5761000      -1.570300    
 O   0.2399000      -2.634100      0.9432000    
 O    5.914400      -1.433600      0.5182000    
 C   -1.842100       3.244300      0.1858000    
 C   -3.179600       2.620100     -0.2321000    
 C  -0.6936000       2.274600      9.3000000E-03
 C   -4.249800      0.3571000      0.3193000    
 C   -4.606200     -0.7623000       1.275000    
 C   -3.529200       1.448600      0.6432000    
 C    1.305700      0.9487000      0.9170000    
 C   0.1436000       1.900500      0.9972000    
 C    2.613500       1.695600      0.6333000    
 C   -4.063200      -2.134200      0.8564000    
 C  -0.5196000       1.708700      -1.378200    
 C   -4.811800      0.2147000      -1.072600    
 C    3.812500      0.7720000      0.6494000    
 C   -2.562700      -2.157200      0.7480000    
 C    4.435800      0.5798000       2.010100    
 C   -1.823700      -2.543100     -0.3085000    
 C    4.356400      0.1609000     -0.4195000    
 C   -2.349000      -3.020400      -1.629100    
 C  -0.3471000      -2.484600     -0.1174000    
 C    5.549000     -0.7134000     -0.3931000    
 H   -1.899400       3.588200       1.226700    
 H   -1.655600       4.138100     -0.4217000    
 H   -3.171500       2.368100      -1.295800    
 H   -3.957800       3.381900     -9.7300000E-02
 H   -5.698500     -0.8202000       1.362200    
 H   -4.237000     -0.5237000       2.281300    
 H   -3.194900       1.523200       1.677800    
 H    1.142100      0.1557000      0.1821000    
 H    1.376200      0.4314000       1.883000    
 H  -1.2100000E-02   2.339900       1.981600    
 H    2.546500       2.170200     -0.3552000    
 H    2.758500       2.518900       1.344000    
 H   -4.550900      -2.447700     -7.0699997E-02
 H   -4.356800      -2.868300       1.617000    
 H   -1.407500       1.160900      -1.705400    
 H   0.3146000       1.013500      -1.483700    
 H   -4.931600       1.167700      -1.594700    
 H   -4.172800     -0.4350000      -1.678000    
 H   -5.812000     -0.2314000      -1.032900    
 H   -2.054100      -1.834900       1.656500    
 H    5.527500      0.5182000       1.974200    
 H    4.214700       1.430000       2.665100    
 H    4.033800     -0.3189000       2.488700    
 H    3.922200      0.3392000      -1.400500    
 H   0.5471000       3.211100      -2.019000    
 H   -3.398600      -3.320200      -1.591700    
 H   -1.787800      -3.899100      -1.966000    
 H   -2.246300      -2.235300      -2.385100    
 H    1.251600      -2.189700      -1.188400    
 H    7.012900      -1.131800      -1.607200    


%chk=000125312-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000125312

0 1
O -1.052127 3.575130 -2.557243
O 0.384816 -4.255874 -0.194531
O 6.927769 0.874177 -1.221204
O 0.442806 -2.010084 0.367070
O 6.279555 -1.093066 -0.174646
C -1.816603 3.568805 0.311632
C -3.265096 3.055474 0.047741
C -0.722140 2.668509 -0.253235
C -4.204120 0.639173 0.169402
C -4.476849 -0.592068 1.032878
C -3.555472 1.718104 0.698210
C 1.392780 1.226436 0.181189
C 0.255231 2.157298 0.551507
C 2.690084 1.553668 0.986970
C -3.952445 -1.937959 0.457174
C -0.814411 2.362210 -1.737567
C -4.753931 0.580078 -1.246473
C 3.808046 0.556735 0.718785
C -2.444502 -2.023065 0.381674
C 3.636342 -0.817817 1.324470
C -1.724835 -3.160441 0.124365
C 4.877441 0.946401 -0.050886
C -2.330445 -4.520625 -0.157293
C -0.242246 -3.038900 0.121935
C 6.026941 0.113766 -0.436927
H -1.660665 3.692290 1.401277
H -1.741650 4.577013 -0.143226
H -3.445696 3.033196 -1.041032
H -3.962686 3.815904 0.459845
H -5.574730 -0.697109 1.165704
H -4.048613 -0.440563 2.042360
H -3.211872 1.637314 1.743359
H 1.622953 1.271128 -0.900056
H 1.087124 0.182478 0.387055
H 0.204305 2.409373 1.624191
H 3.018899 2.580491 0.741092
H 2.435756 1.535337 2.067102
H -4.386084 -2.103257 -0.551685
H -4.342903 -2.768927 1.079183
H -1.695228 1.731868 -1.954253
H 0.082482 1.822703 -2.098414
H -4.678578 1.544659 -1.772854
H -4.220931 -0.174628 -1.858210
H -5.821779 0.283993 -1.237634
H -1.884180 -1.090479 0.547785
H 4.478812 -1.482682 1.087478
H 3.543324 -0.726034 2.425161
H 2.692654 -1.278094 0.973231
H 4.918487 1.971441 -0.435858
H -0.306583 4.207936 -2.396738
H -3.431355 -4.483310 -0.142802
H -1.992799 -5.267067 0.584202
H -2.007291 -4.897477 -1.144277
H 1.370937 -4.121858 -0.182428
H 7.693598 0.288094 -1.467553


