%chk=000156051.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000156051

0 1
 O   -2.202600      -3.378000       1.722300    
 O  -0.4231000      -4.219600      0.4084000    
 O   -2.795300      -3.963200      -1.234500    
 O    1.507000      0.2329000      0.2312000    
 O   -1.646800       3.907100      7.2800003E-02
 O    4.471300      -2.325200     -0.9800000    
 O   -4.212200       4.615700     -0.7290000    
 O    6.231600     -0.4271000     -0.6808000    
 O    4.634900       3.713200       1.006000    
 C   -1.849600      -1.059000       1.400700    
 C  -0.6558000      -1.822700      0.7941000    
 C   -2.948600     -0.8149000      0.2904000    
 C   -1.358200      -3.185400      0.5781000    
 C   -2.536800      -1.556900      -1.014900    
 C  -0.2016000      -1.222200     -0.5179000    
 C   -2.328200      -2.115100       2.396700    
 C   -2.303300      -3.018200     -0.6273000    
 C   -1.162900      -1.114600      -1.451600    
 C   -3.284300      0.6447000      1.6700000E-02
 C    1.226500     -0.8219000     -0.6984000    
 C    2.148700      -2.012400     -0.4652000    
 C   -2.303800       1.620300      0.1709000    
 C   -4.570200      0.9945000     -0.3848000    
 C    3.579700      -1.565700     -0.6206000    
 C    2.812600      0.6500000      0.1825000    
 C   -2.611900       2.957600     -7.8900002E-02
 C   -4.878400       2.331700     -0.6346000    
 C    3.864600     -0.1660000     -0.2437000    
 C   -3.899100       3.313300     -0.4816000    
 C    3.074700       1.950000      0.6162000    
 C    5.172400      0.3242000     -0.2696000    
 C    4.380300       2.441300      0.5927000    
 C    5.425700       1.631800      0.1462000    
 C  -0.3574000       3.460200      0.4874000    
 H   -1.565600     -0.1562000       1.947000    
 H   0.1550000      -1.905800       1.526300    
 H   -3.883000      -1.270300      0.6511000    
 H   -3.276200      -1.476600      -1.816000    
 H   -1.683000      -2.145400       3.282100    
 H   -3.360600      -1.974100       2.729100    
 H  -0.9881000     -0.7122000      -2.441300    
 H    1.369700     -0.4261000      -1.714700    
 H  -0.8921000      -4.984200      3.3700000E-02
 H    1.946100      -2.802100      -1.197500    
 H    2.064200      -2.429800      0.5438000    
 H   -1.308000       1.309800      0.4539000    
 H   -5.340700      0.2387000     -0.5098000    
 H   -5.882800       2.602200     -0.9487000    
 H    2.269500       2.582900      0.9751000    
 H    6.440600       2.022800      0.1307000    
 H   -3.418000       5.155800     -0.5736000    
 H   9.8600000E-02   2.811700     -0.2679000    
 H  -0.3864000       2.997500       1.479900    
 H   0.2789000       4.347500      0.5697000    
 H    7.046700      9.9699996E-02 -0.6198000    
 H    5.588200       3.887500      0.9231000    


%chk=000156051-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000156051

0 1
O -2.250595 -3.431504 1.803882
O -0.443665 -4.318161 0.472173
O -2.801698 -4.129072 -1.173648
O 1.481322 0.185538 0.205345
O -1.611018 3.993043 -0.354817
O 4.469424 -2.188989 -1.546253
O -4.147116 4.639116 -0.914140
O 6.246938 -0.233723 -0.872598
O 4.488702 3.523222 1.732202
C -1.839941 -1.098694 1.490890
C -0.653172 -1.872984 0.806589
C -2.976986 -0.848921 0.437915
C -1.353046 -3.244292 0.611646
C -2.638737 -1.652768 -0.896300
C -0.265948 -1.282068 -0.534586
C -2.270495 -2.135678 2.544703
C -2.352984 -3.126837 -0.565996
C -1.294516 -1.165645 -1.421116
C -3.259447 0.619125 0.122881
C 1.147259 -0.867103 -0.825061
C 2.183343 -1.996607 -0.748223
C -2.223596 1.594455 0.077548
C -4.583628 1.018607 -0.182842
C 3.615415 -1.472925 -0.950573
C 2.814451 0.605997 0.252060
C -2.528033 2.923195 -0.268100
C -4.889096 2.354249 -0.531783
C 3.882824 -0.135876 -0.360712
C -3.862766 3.312577 -0.577787
C 3.026561 1.809857 0.948658
C 5.191492 0.443384 -0.269937
C 4.334303 2.322016 1.033047
C 5.421491 1.656040 0.418639
C -0.215807 3.723677 0.000361
H -1.502776 -0.159651 1.956505
H 0.195989 -1.979093 1.501230
H -3.911650 -1.294272 0.829062
H -3.453330 -1.564540 -1.630350
H -1.558366 -2.188307 3.391707
H -3.293445 -1.989722 2.929280
H -1.193765 -0.759374 -2.431800
H 1.206210 -0.370803 -1.816083
H -0.928035 -5.084296 0.059370
H 1.978355 -2.757142 -1.520191
H 2.119786 -2.508113 0.232104
H -1.190003 1.310935 0.297441
H -5.392901 0.279527 -0.144412
H -5.911794 2.666647 -0.762100
H 2.193105 2.339221 1.414054
H 6.435681 2.074729 0.473277
H -3.298493 5.156440 -0.885399
H 0.222626 2.950639 -0.658179
H -0.136750 3.397137 1.055235
H 0.313010 4.678018 -0.137252
H 7.104280 0.238387 -0.711276
H 5.433929 3.815082 1.749809


