%chk=000054272.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000054272

0 1
 O   -2.517100      -3.213900      -1.014100    
 O    4.597400      -1.600400      0.1021000    
 O    5.696300      0.8944000     -9.5299996E-02
 C   8.5299999E-02  0.2621000      3.8100000E-02
 C  -0.4292000      -1.053600      0.1416000    
 C  -0.8649000       1.313600     -2.3399999E-02
 C   -1.816100      -1.280100      0.1797000    
 C   -2.255000       1.092100      1.4400000E-02
 C   -2.736600     -0.2252000      0.1176000    
 C    1.512400      0.4578000      1.8000000E-03
 C    2.368700     -0.6722000      7.0299998E-02
 C   0.4457000      -2.141400      0.2069000    
 C    1.823400      -1.954000      0.1717000    
 C   -2.337900      -2.689500      0.2903000    
 C  -0.4874000       2.762900     -0.1353000    
 C   -3.173300       2.154500     -4.8400000E-02
 C   -4.122900     -0.4533000      0.1558000    
 C    2.140800       1.724700     -9.9699996E-02
 C    3.764900     -0.5160000      3.7300002E-02
 C   -4.547200       1.914700     -9.3999999E-03
 C   -5.021700      0.6112000      9.2699997E-02
 C    3.531000       1.866400     -0.1316000    
 C    4.343200      0.7454000     -6.3100003E-02
 H   0.1281000      -3.176800      0.2540000    
 H    2.456000      -2.838100      0.2189000    
 H   -1.696500      -3.359100      0.8685000    
 H   -3.279600      -2.767900      0.8387000    
 H   6.3900001E-02   3.059800      0.7640000    
 H   3.8899999E-02   2.922900      -1.083200    
 H   -1.238800       3.542000     -0.1842000    
 H   -2.949100       3.207100     -0.1278000    
 H    1.683200       2.689200     -0.1610000    
 H   -4.569600      -1.440000      0.2047000    
 H   -5.247400       2.743600     -5.9999999E-02
 H   -6.091100      0.4227000      0.1163000    
 H    3.970500       2.857500     -0.2100000    
 H   -1.720500      -3.025000      -1.538300    
 H    5.444300      -1.335800      0.4973000    
 H    6.106100      7.1500003E-02 -0.4083000    


%chk=000054272-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000054272

0 1
O -3.052101 -3.292794 -0.637710
O 4.864939 -1.362058 -0.246938
O 5.807612 1.109501 0.240837
C 0.118401 0.315978 -0.000384
C -0.377234 -1.057987 0.124277
C -0.823167 1.362705 -0.224083
C -1.767135 -1.327454 0.269617
C -2.232244 1.097729 -0.066950
C -2.706748 -0.245384 0.215486
C 1.579087 0.537553 0.090002
C 2.477768 -0.581425 -0.075770
C 0.584432 -2.142897 0.005706
C 1.932595 -1.919256 -0.156545
C -2.284714 -2.736350 0.504959
C -0.421930 2.737961 -0.744848
C -3.206501 2.155025 -0.156782
C -4.120954 -0.466661 0.371022
C 2.162551 1.797542 0.423961
C 3.882342 -0.358066 -0.062379
C -4.567598 1.911655 0.021234
C -5.031667 0.583512 0.280650
C 3.553184 1.987499 0.489091
C 4.425786 0.914485 0.208937
H 0.226835 -3.175599 0.009456
H 2.596052 -2.786512 -0.271586
H -1.475080 -3.431631 0.785275
H -3.011797 -2.744342 1.334056
H -0.404612 3.517748 0.042194
H 0.570810 2.715934 -1.217994
H -1.142621 3.071109 -1.511881
H -2.873736 3.180123 -0.339696
H 1.522600 2.635915 0.698340
H -4.487189 -1.483835 0.530161
H -5.284993 2.737700 -0.037248
H -6.103892 0.394068 0.400669
H 3.982619 2.955788 0.760502
H -2.560117 -3.089498 -1.473384
H 4.491810 -2.188009 -0.635936
H 6.254804 0.244029 0.043283


