%chk=000088787.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000088787

0 1
 O   2.8700000E-02  0.8173000     -6.9999998E-04
 O   -1.278300       2.712300      1.9999999E-04
 C    2.415100      0.7251000       0.000000    
 C    1.212600       1.622400      1.9999999E-04
 C    4.643800     -0.9380000      3.0000001E-04
 C    2.967600      0.3139000      -1.207900    
 C    2.966200      0.3129000       1.208200    
 C   -2.291000      0.5537000     -1.9999999E-04
 C    4.085400     -0.5204000      -1.207700    
 C    4.084200     -0.5213000       1.208300    
 C   -4.443100      -1.221600     -1.9999999E-04
 C   -3.597500       1.041800      1.1000000E-03
 C   -2.060300     -0.8221000     -1.6000000E-03
 C   -4.673600      0.1543000      1.3000000E-03
 C   -3.136300      -1.709700     -1.6000000E-03
 C   -1.168900       1.479000     -6.0000003E-04
 C    5.839500      -1.829200      3.9999999E-04
 C   -5.593900      -2.170500      6.9999998E-04
 H    1.219000       2.267500      0.8876000    
 H    1.219700       2.268500     -0.8864000    
 H    2.539600      0.6319000      -2.154600    
 H    2.537300      0.6300000       2.154700    
 H    4.513100     -0.8370000      -2.155300    
 H    4.511100     -0.8386000       2.156000    
 H   -3.799300       2.109800      1.8000000E-03
 H   -1.060600      -1.247200     -3.3000000E-03
 H   -5.687100      0.5466000      6.9999998E-04
 H   -2.944400      -2.779400     -4.4000000E-03
 H    5.847700      -2.479400      0.8818000    
 H    5.845600      -2.482100     -0.8791000    
 H    6.755000      -1.229400     -1.5000000E-03
 H   -5.337600      -3.102000      0.5167000    
 H   -6.457700      -1.743400      0.5214000    
 H   -5.885800      -2.407600      -1.027100    


%chk=000088787-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000088787

0 1
O 0.045944 0.757739 -0.000296
O -1.269256 2.685596 -0.001126
C 2.477886 0.760947 -0.003412
C 1.260278 1.647618 -0.004852
C 4.789458 -0.935097 -0.000544
C 3.061584 0.328113 -1.220077
C 3.063954 0.335469 1.214693
C -2.336631 0.487558 0.005184
C 4.197605 -0.508538 -1.218006
C 4.199977 -0.501209 1.215459
C -4.609118 -1.235816 0.015001
C -3.647773 1.030451 0.009428
C -2.164462 -0.920909 0.008533
C -4.766592 0.176323 0.015969
C -3.291263 -1.766398 0.014976
C -1.183984 1.430171 0.001426
C 6.034461 -1.804737 0.000797
C -5.817405 -2.153392 -0.010627
H 1.203494 2.295701 0.887747
H 1.201221 2.289675 -0.901654
H 2.618907 0.644239 -2.172568
H 2.623119 0.657335 2.166115
H 4.633479 -0.834267 -2.170387
H 4.637681 -0.821193 2.168940
H -3.762366 2.119570 0.011343
H -1.151079 -1.332047 0.009858
H -5.776295 0.603928 0.023438
H -3.151574 -2.854106 0.021433
H 6.079778 -2.446829 0.897891
H 6.075470 -2.455698 -0.890111
H 6.951398 -1.183418 -0.004533
H -5.606546 -3.116826 0.485360
H -6.688394 -1.691838 0.486521
H -6.117154 -2.380016 -1.052719


