%chk=000044350.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000044350

0 1
 O    3.860700       3.037400     -0.8270000    
 C  -0.8504000      0.1320000      3.2099999E-02
 C   0.5779000      5.3100001E-02  4.7600001E-02
 C   -1.650800      -1.037000     -2.4100000E-02
 C   -1.475000       1.399300      7.3500000E-02
 C    1.245600      -1.196800      7.7999998E-03
 C    1.336900       1.244200      0.1039000    
 C   -3.086000     -0.9283000     -3.8699999E-02
 C   -2.869300       1.494300      5.9300002E-02
 C    2.684200      -1.246800      2.5000000E-02
 C   -3.678600      0.3564000      4.1000000E-03
 C    2.733300       1.185100      0.1198000    
 C    3.413400     -3.5000000E-02  8.1600003E-02
 C  -0.9657000      -2.264400     -6.3199997E-02
 C  -0.6975000       2.559600      0.1288000    
 C   0.4307000      -2.341600     -4.7699999E-02
 C   0.6908000       2.483100      0.1437000    
 C   -3.513100       2.856900      0.1041000    
 C   -3.973000      -2.034600     -9.3999997E-02
 C   -5.077100      0.5016000     -8.2000000E-03
 C    3.444900      -2.444000     -1.0800000E-02
 C    4.819400     -4.4599999E-02  9.9900000E-02
 C    3.502000       2.437000      0.1795000    
 C   -5.361600      -1.877800     -0.1060000    
 C   -5.914300     -0.6081000     -6.3000001E-02
 C    4.842300      -2.441100      8.2000000E-03
 C    5.530200      -1.239800      6.3600004E-02
 H   -1.501100      -3.209400     -0.1071000    
 H   -1.099900       3.565900      0.1252000    
 H   0.8596000      -3.339800     -8.0899999E-02
 H    1.235300       3.423400      0.1815000    
 H   -3.687200       3.229200     -0.9103000    
 H   -2.940800       3.598700      0.6655000    
 H   -4.453200       2.871700      0.6616000    
 H   -3.598300      -3.054300     -0.1299000    
 H   -5.587500       1.458300     -1.5100000E-02
 H    2.961200      -3.416400     -5.4699998E-02
 H    5.405800      0.8701000      0.1453000    
 H    3.735200       2.803300       1.194000    
 H   -6.005300      -2.751500     -0.1511000    
 H   -6.992300     -0.4803000     -8.0600001E-02
 H    5.386700      -3.380400     -2.0400001E-02
 H    6.615800      -1.230900      7.9099998E-02


%chk=000044350-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000044350

0 1
O 3.311739 3.702395 0.320312
C -0.854012 0.209811 0.037528
C 0.594443 0.132702 0.067231
C -1.638128 -0.989571 0.008435
C -1.524505 1.506087 0.038516
C 1.248202 -1.146299 0.064367
C 1.396883 1.346909 0.117930
C -3.091812 -0.912398 -0.029273
C -2.939617 1.593743 -0.000821
C 2.704912 -1.229073 0.058688
C -3.732506 0.383792 -0.035731
C 2.824171 1.279453 0.172962
C 3.492378 -0.017649 0.101456
C -0.953255 -2.245861 0.022694
C -0.680898 2.682364 0.086205
C 0.432164 -2.322143 0.050100
C 0.694525 2.614813 0.127906
C -3.671412 2.925272 -0.007579
C -3.917138 -2.080932 -0.062865
C -5.167533 0.441713 -0.075482
C 3.378459 -2.490353 -0.006326
C 4.923160 -0.143392 0.030967
C 3.662645 2.482896 0.381398
C -5.312221 -1.993968 -0.101036
C -5.945480 -0.717340 -0.107366
C 4.771935 -2.580761 -0.043007
C 5.550687 -1.390049 -0.034418
H -1.522464 -3.178591 0.012922
H -1.140538 3.673381 0.090568
H 0.894523 -3.311451 0.061999
H 1.291864 3.527349 0.159002
H -4.297009 3.027991 -0.914367
H -2.996978 3.790385 0.020083
H -4.348040 3.009691 0.863726
H -3.459354 -3.073641 -0.060441
H -5.666375 1.414249 -0.080785
H 2.799115 -3.416098 -0.040300
H 5.555283 0.746529 0.000132
H 4.718447 2.267298 0.654978
H -5.917747 -2.906349 -0.126548
H -7.038147 -0.647635 -0.137205
H 5.260469 -3.559427 -0.094550
H 6.643067 -1.448140 -0.090101


