%chk=000147611.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000147611

0 1
 O  -0.1987000      -1.106300       1.587600    
 O  -0.2635000       1.824800      -2.207100    
 C   -2.667500      0.2299000      0.4976000    
 C   -1.671000     -0.1104000     -0.6479000    
 C   -3.997800     -0.5115000      0.2952000    
 C   -3.792300      -2.036500      0.2703000    
 C   -1.695600      -1.575900      -1.024200    
 C  -0.2566000      0.3510000     -0.3156000    
 C   -2.629400      -2.437200     -0.5971000    
 C   -2.922500       1.706700      0.5943000    
 C   -5.076400      -2.729300     -0.1881000    
 C   0.4018000     -0.1779000      0.7911000    
 C   0.3690000       1.298900      -1.120700    
 C   -3.516400       2.356300     -0.6203000    
 C    2.326700       1.193700      0.2914000    
 C    1.696000      0.2443000       1.095100    
 C    1.663300       1.721200     -0.8164000    
 C   -2.636100       2.404500       1.703300    
 C    3.710500       1.645100      0.6163000    
 C    4.823300      0.8122000     -4.6100002E-02
 C    4.741200     -0.6762000      0.3065000    
 C    5.845700      -1.471800     -0.3902000    
 C    5.746500      -2.955800     -7.5099997E-02
 H   -2.284500     -0.1158000       1.464200    
 H   -2.006000      0.3596000      -1.575700    
 H   -4.468600     -0.1998000     -0.6473000    
 H   -4.704200     -0.2557000       1.096200    
 H   -3.571600      -2.377500       1.290300    
 H  -0.9057000      -1.948600      -1.672600    
 H   -2.545200      -3.481600     -0.8863000    
 H   -5.916200      -2.456800      0.4603000    
 H   -5.338100      -2.452300      -1.215600    
 H   -4.968900      -3.819100     -0.1520000    
 H   -3.074200       2.057200      -1.567300    
 H   -4.588000       2.135100     -0.6748000    
 H   -3.422300       3.447400     -0.5663000    
 H    2.210700     -0.1637000       1.961800    
 H    2.150600       2.460300      -1.447900    
 H   -2.825700       3.471100       1.762400    
 H   -2.205400       1.927900       2.577600    
 H    3.833800       2.695900      0.3234000    
 H    3.852800       1.633300       1.705100    
 H    4.760700      0.9299000      -1.135400    
 H    5.796200       1.212600      0.2635000    
 H    3.780800      -1.094400     -1.1800000E-02
 H    4.817100     -0.8056000       1.392600    
 H   0.4112000      -1.353800       2.303500    
 H   -1.123100       2.163600      -1.914200    
 H    5.779700      -1.331000      -1.475400    
 H    6.827300      -1.100300     -7.3799998E-02
 H    5.837600      -3.135100       1.001000    
 H    6.547400      -3.504800     -0.5800000    
 H    4.789100      -3.365800     -0.4121000    


%chk=000147611-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000147611

0 1
O -0.496375 -1.085280 1.904630
O 0.015221 1.701084 -2.085749
C -2.844703 0.310290 0.408839
C -1.710627 -0.221979 -0.543694
C -4.176476 -0.428395 0.108111
C -4.066398 -1.951438 0.358912
C -1.780904 -1.738497 -0.721530
C -0.313205 0.231344 -0.110442
C -2.824480 -2.505714 -0.320783
C -2.983266 1.831371 0.319084
C -5.342758 -2.697072 -0.100837
C 0.281703 -0.229104 1.093839
C 0.476099 1.131441 -0.883361
C -3.686070 2.411173 -0.900100
C 2.351485 1.025292 0.689808
C 1.582871 0.150272 1.493869
C 1.779475 1.519119 -0.502534
C -2.488204 2.638207 1.294685
C 3.763216 1.431835 1.094509
C 4.868034 0.856027 0.162954
C 4.985668 -0.683214 0.215158
C 6.077841 -1.237319 -0.728127
C 6.197136 -2.775783 -0.672102
H -2.535663 0.047715 1.437067
H -1.919127 0.203435 -1.555729
H -4.470071 -0.266201 -0.949692
H -4.983135 -0.002342 0.737002
H -3.955005 -2.113875 1.454566
H -0.912126 -2.200616 -1.210415
H -2.786402 -3.593567 -0.479759
H -6.239012 -2.304139 0.414620
H -5.494942 -2.578525 -1.190234
H -5.273868 -3.779743 0.115436
H -3.285926 2.002804 -1.850505
H -4.765988 2.167596 -0.892641
H -3.585249 3.509146 -0.934775
H 2.000584 -0.231793 2.435482
H 2.321242 2.217672 -1.147534
H -2.559268 3.730942 1.234023
H -1.989996 2.224436 2.179380
H 3.839956 2.537326 1.090393
H 3.962942 1.102125 2.132896
H 4.664479 1.171916 -0.880202
H 5.841354 1.307556 0.445108
H 4.009013 -1.136059 -0.048469
H 5.207043 -0.999867 1.256794
H 0.037909 -1.399438 2.675680
H -0.928979 1.452544 -2.250382
H 5.853299 -0.920144 -1.767034
H 7.054362 -0.779407 -0.467719
H 6.453702 -3.116732 0.348964
H 6.979495 -3.147985 -1.359094
H 5.241593 -3.256441 -0.955068


