%chk=000170835.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000170835

0 1
 O   -2.108800      -3.275900       1.474700    
 O   -4.139600      -2.869300     -0.3768000    
 O    3.508700     -0.8938000      -1.847600    
 O    5.053300     -0.8856000      0.4626000    
 C  -0.3332000       2.425700     -0.3681000    
 C   -1.800200       2.800200     -0.6754000    
 C  -0.2257000       1.177500      0.5618000    
 C   -2.479500       1.613000      -1.372000    
 C   -1.280200      0.1041000      0.2878000    
 C   -2.340500      0.3207000     -0.6117000    
 C   0.4438000       3.622600      0.1993000    
 C    1.197400      0.6205000      0.5318000    
 C   -2.602800       3.270700      0.5443000    
 C   -1.238700      -1.111400      0.9978000    
 C   -3.283100     -0.6965000     -0.8361000    
 C    1.709800      0.1122000     -0.6550000    
 C    1.961700      0.6287000       1.691700    
 C   -2.189800      -2.108100      0.7783000    
 C   -3.207500      -1.903900     -0.1455000    
 C    3.008300     -0.3967000     -0.6823000    
 C    3.260000      0.1199000       1.664500    
 C    3.783500     -0.3926000      0.4775000    
 C    3.303000      -2.282100      -2.101500    
 H   0.1251000       2.197000      -1.340800    
 H   -1.799100       3.635300      -1.389800    
 H  -0.4390000       1.521200       1.585000    
 H   -2.031600       1.467800      -2.363800    
 H   -3.540200       1.845000      -1.530100    
 H   0.1325000       3.861600       1.221100    
 H    1.519400       3.419400      0.2192000    
 H   0.2933000       4.512900     -0.4206000    
 H   -2.176200       4.185000      0.9677000    
 H   -3.634500       3.501200      0.2562000    
 H   -2.641700       2.518400       1.337300    
 H  -0.4568000      -1.289400       1.733000    
 H   -4.086400     -0.5324000      -1.551700    
 H    1.112600      9.6199997E-02  -1.562900    
 H    1.566600       1.025100       2.622700    
 H    3.853000      0.1292000       2.575200    
 H   -2.844500      -3.849200       1.197500    
 H   -4.767700      -2.550200      -1.047300    
 H    5.436000     -0.8015000       1.352800    
 H    2.233100      -2.506900      -2.157700    
 H    3.774500      -2.890500      -1.323200    
 H    3.762700      -2.526400      -3.063000    


%chk=000170835-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000170835

0 1
O -2.204555 -3.352457 1.264186
O -4.326337 -2.875637 -0.353312
O 3.298857 -1.125537 -1.930237
O 5.067910 -0.940641 0.336216
C -0.404545 2.453579 -0.387397
C -1.880449 2.908495 -0.593436
C -0.317358 1.195852 0.539070
C -2.637941 1.780919 -1.334861
C -1.402342 0.148097 0.221017
C -2.505462 0.435229 -0.630086
C 0.501871 3.594157 0.123427
C 1.095049 0.600874 0.520702
C -2.605575 3.310440 0.713487
C -1.321512 -1.123629 0.848151
C -3.497305 -0.558945 -0.838677
C 1.588986 -0.047436 -0.638332
C 1.947937 0.698300 1.644818
C -2.303219 -2.102501 0.637348
C -3.398283 -1.812776 -0.217602
C 2.894847 -0.575646 -0.701177
C 3.260472 0.177060 1.602425
C 3.748690 -0.446808 0.434235
C 3.933101 -2.461025 -1.908921
H -0.028040 2.149972 -1.388470
H -1.857366 3.798475 -1.256864
H -0.501224 1.548663 1.577587
H -2.234607 1.699235 -2.366520
H -3.709188 2.044427 -1.439007
H 0.219780 3.909704 1.145940
H 1.559521 3.278951 0.152465
H 0.426249 4.478707 -0.536491
H -2.064783 4.108092 1.253686
H -3.619821 3.689952 0.488570
H -2.718923 2.447630 1.394305
H -0.478324 -1.367039 1.502288
H -4.351883 -0.336551 -1.492868
H 0.955336 -0.174747 -1.522653
H 1.589459 1.184506 2.559450
H 3.914502 0.267054 2.480661
H -2.982908 -3.905221 0.990271
H -5.065728 -2.639890 -0.962428
H 5.568169 -0.742858 1.166442
H 3.241274 -3.206420 -1.470836
H 4.878210 -2.443411 -1.342528
H 4.118459 -2.700494 -2.967142


