%chk=000041133.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000041133

0 1
 O   -2.784100      -2.387500      0.5372000    
 C  -0.9465000       1.257300     -0.2051000    
 C  -0.5908000     -3.5000000E-02 -0.9988000    
 C    1.843100      0.1124000     -0.2420000    
 C   0.6129000     -0.7885000     -0.3932000    
 C   0.3268000       2.116200      1.2200000E-02
 C    1.510900       1.348700      0.5952000    
 C   -1.581800      0.8885000       1.161700    
 C   -1.787200     -0.9885000      -1.133300    
 C   -1.940000       2.126100      -1.012900    
 C    3.005500     -0.6613000      0.3785000    
 C   -2.779600     -4.8500001E-02   1.048900    
 C   -2.444700      -1.253000      0.2026000    
 C    3.312800      -1.913600     -0.4388000    
 C    4.242700      0.2267000      0.4876000    
 H  -0.2967000      0.2588000      -2.016900    
 H    2.137300      0.4509000      -1.245900    
 H   0.3479000      -1.225500      0.5774000    
 H   0.8334000      -1.625200      -1.065300    
 H   9.8099999E-02   2.968800      0.6644000    
 H   0.6429000       2.543500     -0.9494000    
 H    2.356400       2.044200      0.6214000    
 H    1.304700       1.066500       1.634100    
 H   -1.891300       1.798900       1.690500    
 H  -0.8377000      0.4048000       1.805200    
 H   -1.470200      -1.944100      -1.566600    
 H   -2.548000     -0.5714000      -1.801700    
 H   -1.515000       2.408600      -1.982900    
 H   -2.885700       1.614800      -1.212200    
 H   -2.176800       3.051100     -0.4743000    
 H    2.738300     -0.9853000       1.393200    
 H   -3.645100      0.4545000      0.6067000    
 H   -3.071000     -0.3891000       2.048600    
 H    3.426300      -1.683800      -1.503700    
 H    4.247300      -2.375300     -9.9900000E-02
 H    2.538800      -2.678500     -0.3243000    
 H    4.480600      0.7062000     -0.4680000    
 H    5.116100     -0.3637000      0.7875000    
 H    4.124300       1.003600       1.248700    


%chk=000041133-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000041133

0 1
O -2.679897 -2.489882 0.544543
C -0.992902 1.290059 -0.200859
C -0.611838 0.004562 -1.008817
C 1.861057 0.118260 -0.238236
C 0.594252 -0.759547 -0.399665
C 0.294741 2.145340 0.007747
C 1.501316 1.376649 0.593161
C -1.611551 0.896458 1.174545
C -1.825732 -0.961813 -1.166057
C -2.001587 2.156261 -1.003442
C 3.058710 -0.674524 0.380408
C -2.799274 -0.102426 1.061411
C -2.456640 -1.302948 0.181411
C 3.373218 -1.976243 -0.399346
C 4.340523 0.192006 0.470252
H -0.311720 0.335685 -2.027021
H 2.174472 0.455068 -1.254052
H 0.319140 -1.185251 0.588832
H 0.810000 -1.624469 -1.054682
H 0.052260 3.012068 0.656679
H 0.590585 2.565252 -0.977187
H 2.363908 2.067131 0.639301
H 1.292954 1.067207 1.638698
H -1.957733 1.813130 1.691822
H -0.835772 0.445943 1.821383
H -1.522095 -1.900097 -1.663957
H -2.601961 -0.482457 -1.797069
H -1.603965 2.385133 -2.010621
H -2.982191 1.665117 -1.135981
H -2.180275 3.118392 -0.486508
H 2.765366 -0.960401 1.415085
H -3.668712 0.413128 0.603199
H -3.115485 -0.464737 2.055032
H 3.570935 -1.757532 -1.467173
H 4.274021 -2.466016 0.014987
H 2.547298 -2.706718 -0.347668
H 4.640686 0.549548 -0.534449
H 5.180564 -0.398616 0.880462
H 4.208226 1.074580 1.120230


