%chk=000028357.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000028357

0 1
 O   0.1639000      -1.059500     -0.1247000    
 O  -0.8048000      -1.851900      -2.065400    
 O   -2.425400     -0.3726000       1.054600    
 C    2.129500      0.3555000      4.8700001E-02
 C    1.153000     -0.3735000     -0.8905000    
 C    1.428400       1.496000      0.8022000    
 C  -0.2346000       1.751000      -1.095900    
 C   0.4653000      0.6063000      -1.846000    
 C   0.7454000       2.467900     -0.1585000    
 C    2.785300     -0.6069000       1.040700    
 C  -0.8563000       2.738900      -2.081800    
 C    3.795800      0.1321000       1.913400    
 C    3.454100      -1.762100      0.3012000    
 C  -0.7584000      -1.763500     -0.8452000    
 C   -1.727700      -2.452600      8.3499998E-02
 C   -2.902400      -1.550100      0.4157000    
 C   -3.490200      0.5077000       1.386800    
 C   -2.920800       1.737500       2.061400    
 H    2.914300      0.8053000     -0.5771000    
 H    1.694800      -1.104300      -1.502400    
 H   0.6852000       1.092700       1.501600    
 H    2.141000       2.080900       1.392000    
 H   -1.047800       1.329100     -0.4963000    
 H    1.244500       1.042000      -2.488200    
 H  -0.2446000      0.1610000      -2.542600    
 H    1.510400       2.990500     -0.7470000    
 H   0.2145000       3.233400      0.4201000    
 H    2.027700      -1.035600       1.709700    
 H   -1.585100       2.237300      -2.727300    
 H   -1.378300       3.541000      -1.549300    
 H  -9.4800003E-02   3.196800      -2.722000    
 H    3.309200      0.7986000       2.631400    
 H    4.383800     -0.5773000       2.507100    
 H    4.497900      0.7184000       1.310900    
 H    4.122500      -1.402500     -0.4886000    
 H    4.054300      -2.365800      0.9916000    
 H    2.722700      -2.444300     -0.1425000    
 H   -2.068300      -3.376800     -0.3956000    
 H   -1.187800      -2.743700      0.9923000    
 H   -3.434500      -1.274300     -0.5026000    
 H   -3.594000      -2.078100       1.081800    
 H   -4.026700      0.8012000      0.4777000    
 H   -4.187800      4.6999999E-03   2.065600    
 H   -3.718300       2.427600       2.351200    
 H   -2.352200       1.459200       2.954800    
 H   -2.229200       2.262400       1.395600    


%chk=000028357-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000028357

0 1
O 0.300563 -0.762358 0.381391
O -0.871642 -2.026594 -1.191987
O -3.162363 -0.314004 0.863050
C 2.453613 0.315737 -0.029963
C 1.150804 -0.156822 -0.713248
C 2.147103 1.499341 0.929780
C 0.051849 2.149180 -0.409025
C 0.358123 0.983384 -1.378815
C 1.372137 2.642297 0.231307
C 3.230796 -0.848605 0.663803
C -0.696407 3.288212 -1.131412
C 4.579806 -0.362074 1.250424
C 3.490206 -2.036394 -0.297937
C -0.697083 -1.643461 -0.009310
C -1.548027 -2.077035 1.176116
C -3.028184 -1.774527 0.905084
C -4.505924 0.118677 0.451433
C -4.521874 1.646840 0.469442
H 3.095961 0.699142 -0.855967
H 1.340334 -0.955610 -1.451934
H 1.551429 1.117783 1.782787
H 3.090422 1.900020 1.343564
H -0.599001 1.753808 0.398034
H 0.966637 1.363750 -2.226674
H -0.573244 0.573558 -1.810801
H 2.009493 3.089908 -0.562311
H 1.159019 3.449342 0.960220
H 2.598279 -1.213733 1.498636
H -1.648304 2.929408 -1.567232
H -0.931427 4.116069 -0.436128
H -0.083662 3.703059 -1.955800
H 4.447010 0.388662 2.048689
H 5.139907 -1.210921 1.684764
H 5.212397 0.088005 0.459751
H 4.040826 -1.702123 -1.199530
H 4.104785 -2.808476 0.201364
H 2.557075 -2.524805 -0.629974
H -1.427933 -3.168188 1.314385
H -1.214557 -1.562282 2.090825
H -3.334614 -2.222072 -0.064899
H -3.664294 -2.196463 1.713795
H -4.727985 -0.273028 -0.566109
H -5.266508 -0.295399 1.151461
H -5.508658 2.027699 0.148898
H -4.311629 2.023618 1.485254
H -3.751752 2.047072 -0.213102


