%chk=000105381.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000105381

0 1
 O  -0.5859000     -0.6650000     -1.2300000E-02
 O    2.867900      0.4550000     -5.4000001E-03
 C   -1.852700     -5.7999999E-03 -1.9999999E-04
 C   -1.948000      0.8868000      -1.236700    
 C   -2.933100      -1.084600     -3.1700000E-02
 C   -1.957900      0.8227000       1.279300    
 C   0.4812000      0.2696000      8.3999997E-03
 C    1.798000     -0.4824000     -5.5000000E-03
 C    4.130600     -0.1963000      4.0000002E-03
 H   -1.603600      0.3616000      -2.134800    
 H   -2.984600       1.201400      -1.406000    
 H   -1.365900       1.810300      -1.148500    
 H   -2.837000      -1.755800      0.8295000    
 H   -2.830500      -1.711000     -0.9254000    
 H   -3.939700     -0.6540000     -2.4499999E-02
 H   -1.621100      0.2516000       2.152100    
 H   -1.373500       1.748100       1.243600    
 H   -2.995500       1.129700       1.455900    
 H   0.4815000      0.9263000     -0.8665000    
 H   0.4785000      0.8919000      0.9081000    
 H    1.856300      -1.119700     -0.8963000    
 H    1.865100      -1.133700      0.8746000    
 H    4.247600     -0.8193000     -0.8880000    
 H    4.241600     -0.8050000      0.9065000    
 H    4.912300      0.5681000      6.0000003E-04


%chk=000105381-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000105381

0 1
O -0.543725 -0.534115 -0.011843
O 2.995118 0.410178 0.009323
C -1.910023 0.075806 0.000799
C -2.127857 0.949954 -1.256925
C -2.826744 -1.161724 -0.029472
C -2.130844 0.889214 1.298166
C 0.594808 0.390417 0.008593
C 1.841033 -0.495248 -0.005404
C 4.261902 -0.315319 0.004688
H -1.883941 0.373548 -2.166987
H -3.184354 1.268955 -1.319583
H -1.504966 1.862411 -1.241339
H -2.630399 -1.799783 0.849494
H -2.629815 -1.757121 -0.937778
H -3.889823 -0.861647 -0.022676
H -1.896883 0.267202 2.180433
H -1.501819 1.796921 1.331046
H -3.185691 1.211791 1.369286
H 0.602079 1.053869 -0.879675
H 0.597538 1.019625 0.921415
H 1.848567 -1.130520 -0.917275
H 1.848646 -1.159772 0.885376
H 4.369252 -0.944198 -0.905476
H 4.362676 -0.966947 0.899475
H 5.056864 0.447004 0.017140


