%chk=000151611.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000151611

0 1
 O    2.910900     -0.2625000     -0.3599000    
 O    2.028700      0.8600000       1.485200    
 O    6.327100      -1.242900       1.699400    
 O    4.607400      0.9567000       2.636400    
 O    6.300000      -1.347700      -1.205200    
 O    4.439300      -1.736400      -3.172000    
 O    2.346400      -1.803300      -2.254500    
 C    5.502400     -0.4226000      0.8704000    
 C    4.251700     -7.4000000E-03   1.645700    
 C    5.142500      -1.225100     -0.3803000    
 C    3.208900      0.6191000      0.7198000    
 C    4.047500     -0.5245000      -1.175000    
 C   -1.341500       1.361200      5.5199999E-02
 C   -2.598700      0.6995000     -3.4899998E-02
 C  -0.2678000      0.7558000      0.7431000    
 C   0.9679000       1.414500      0.8274000    
 C   -2.799200     -0.5743000      0.5604000    
 C   -1.152900       2.631100     -0.5426000    
 C   -3.652200       1.331200     -0.7303000    
 C   -4.082800      -1.214100      0.4494000    
 C    3.505800      -1.418400      -2.243100    
 C  -0.4605000     -0.4946000       1.329300    
 C   -1.695900      -1.141200       1.238700    
 C    1.146000       2.663000      0.2373000    
 C   -5.122500     -0.5572000     -0.2544000    
 C   9.2900001E-02   3.268300     -0.4436000    
 C   -4.893600      0.6970000     -0.8297000    
 C   -2.216000       3.230400      -1.223900    
 C   -3.449100       2.588200      -1.316000    
 C   -4.393100      -2.482300       1.003400    
 C   -6.388700      -1.154900     -0.3817000    
 C   -5.656000      -3.065700      0.8697000    
 C   -6.654800      -2.401200      0.1763000    
 H    6.101400      0.4605000      0.6152000    
 H    3.825000     -0.8692000       2.173800    
 H    4.837200      -2.240000     -9.7000003E-02
 H    3.595700       1.570400      0.3317000    
 H    4.385700      0.4052000      -1.648800    
 H   0.3407000     -0.9962000       1.867800    
 H    7.106300      -1.496000       1.175200    
 H   -1.770400      -2.113100       1.720000    
 H    5.288100      0.5537000       3.202100    
 H    2.089900       3.195200      0.3138000    
 H    6.581800     -0.4537000      -1.464100    
 H   0.2524000       4.246200     -0.8931000    
 H   -5.701700       1.192700      -1.368800    
 H   -2.097300       4.205500      -1.691800    
 H   -4.254200       3.084800      -1.854400    
 H   -3.650600      -3.050700       1.557700    
 H   -7.186800     -0.6492000     -0.9227000    
 H   -5.852500      -4.039100       1.309500    
 H   -7.637900      -2.848900      6.8800002E-02
 H    4.077000      -2.322800      -3.870000    


%chk=000151611-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000151611

0 1
O 2.916917 -0.961689 0.173558
O 2.096062 0.788005 1.457566
O 6.843641 0.365076 0.822750
O 4.654044 2.165615 1.220508
O 6.393749 -1.655383 -1.146926
O 4.564834 -3.597564 -1.711766
O 2.432204 -3.489917 -0.788815
C 5.562760 0.153909 0.146643
C 4.486726 0.719763 1.083992
C 5.340424 -1.328000 -0.188427
C 3.093282 0.486643 0.482760
C 3.901062 -1.474954 -0.777082
C -1.438633 1.566611 0.408949
C -2.679747 0.888733 0.133165
C -0.265178 0.800695 0.751353
C 0.943004 1.509133 1.020971
C -2.755952 -0.543675 0.192710
C -1.362939 3.007863 0.341255
C -3.857372 1.672478 -0.208843
C -4.018985 -1.208551 -0.089021
C 3.499466 -2.922899 -1.056312
C -0.356753 -0.634803 0.799167
C -1.557615 -1.273077 0.529526
C 1.019979 2.909623 0.956495
C -5.179510 -0.405477 -0.425964
C -0.130676 3.654206 0.613259
C -5.068509 1.016481 -0.477555
C -2.555672 3.758103 -0.002329
C -3.748812 3.118372 -0.264324
C -4.177885 -2.632410 -0.050445
C -6.430688 -1.052689 -0.705488
C -5.407701 -3.237430 -0.327320
C -6.548343 -2.441443 -0.658524
H 5.542699 0.719306 -0.812396
H 4.542881 0.210816 2.067700
H 5.418912 -1.946111 0.730521
H 2.955139 1.085782 -0.444225
H 3.871326 -0.918581 -1.743693
H 0.542974 -1.208898 1.035614
H 7.553063 -0.030108 0.253304
H -1.583219 -2.365365 0.570263
H 5.592594 2.325067 1.500561
H 1.973443 3.394844 1.189244
H 6.215834 -2.568737 -1.500599
H -0.076508 4.747678 0.564770
H -5.956568 1.607528 -0.734482
H -2.486818 4.851232 -0.047972
H -4.645237 3.694577 -0.521931
H -3.324626 -3.269258 0.200517
H -7.297465 -0.430231 -0.957894
H -5.499748 -4.328505 -0.289993
H -7.507476 -2.925155 -0.873138
H 4.291516 -4.532228 -1.916758


