%chk=000040152.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000040152

0 1
 O   0.4831000       2.581300     -0.7845000    
 C   4.3499999E-02  0.2241000     -0.4320000    
 C  -0.9199000     -0.8463000      0.1330000    
 C    1.488400     -1.7000000E-03  8.8600002E-02
 C  -0.4343000       1.675400     -0.1665000    
 C   -2.363800     -0.7951000     -0.3787000    
 C    2.050100      -1.389200     -0.2406000    
 C  -0.5645000       2.045700       1.307000    
 C   -3.233500      -1.926400      0.1471000    
 C    3.450900      -1.568000      0.3267000    
 H   8.3099999E-02  9.1899998E-02  -1.522700    
 H  -0.9208000     -0.8070000       1.229000    
 H  -0.5502000      -1.841400     -0.1342000    
 H    2.158300      0.7545000     -0.3379000    
 H    1.511500      0.1312000       1.176800    
 H   -1.402500       1.839100     -0.6520000    
 H   -2.827600      0.1532000     -8.6700000E-02
 H   -2.361600     -0.8276000      -1.474500    
 H    2.071300      -1.535600      -1.326400    
 H    1.432200      -2.181900      0.1894000    
 H  -0.9108000       3.081600       1.399100    
 H   0.4004000       2.005000       1.821400    
 H   -1.277400       1.404400       1.831400    
 H   -3.285000      -1.902900       1.240200    
 H   -4.251500      -1.837300     -0.2446000    
 H   -2.835300      -2.899400     -0.1573000    
 H    3.836000      -2.562300      7.9599999E-02
 H    3.449700      -1.465200       1.416600    
 H    4.139300     -0.8249000     -8.8299997E-02
 H   0.5128000       2.367300      -1.732600    


%chk=000040152-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000040152

0 1
O 0.492751 2.532415 -0.901910
C 0.010146 0.150353 -0.318319
C -1.032079 -0.841461 0.271228
C 1.430052 -0.094143 0.260800
C -0.434085 1.635365 -0.166364
C -2.423053 -0.828172 -0.407939
C 2.155093 -1.313635 -0.356084
C -0.449704 2.171874 1.269476
C -3.345203 -1.949779 0.117781
C 3.553626 -1.547063 0.255448
H 0.059359 -0.045542 -1.416742
H -1.151075 -0.646487 1.357367
H -0.620713 -1.868092 0.190616
H 2.044914 0.811449 0.087255
H 1.363374 -0.230722 1.359954
H -1.449345 1.745073 -0.605586
H -2.918610 0.150276 -0.250610
H -2.292783 -0.939248 -1.504436
H 2.252807 -1.158968 -1.450731
H 1.542392 -2.228324 -0.225608
H -0.774225 3.226513 1.268126
H 0.558581 2.127888 1.715216
H -1.145114 1.593850 1.903375
H -3.500506 -1.855603 1.209273
H -4.337785 -1.919860 -0.368125
H -2.904635 -2.946820 -0.072012
H 4.060957 -2.412235 -0.210206
H 3.483387 -1.741000 1.342523
H 4.199060 -0.659522 0.115623
H 0.544318 2.224121 -1.842985


