%chk=000154268.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000154268

0 1
 O    2.173500     -0.6244000     -0.2831000    
 O    4.951300     -0.9680000     -0.3815000    
 C   0.9632000       1.946200      7.7000000E-03
 C   -3.453900     -0.3778000      6.2399998E-02
 C   0.1753000      0.6797000     -5.6400001E-02
 C   -1.920300     -0.4398000     -3.1199999E-02
 C   -1.215800      0.7364000      2.8700000E-02
 C   2.8600000E-02   3.184400      0.1688000    
 C    1.803000       2.154700      -1.289800    
 C    1.986700       2.039300       1.186900    
 C   0.8157000     -0.5512000     -0.1984000    
 C   -3.932700      -1.187700       1.286700    
 C   -4.077200     -0.9758000      -1.217400    
 C   -4.013400       1.054700      0.2158000    
 C   -1.326100      -1.668900     -0.1705000    
 C   6.4999998E-02  -1.725500     -0.2555000    
 C    2.791300      -1.807700      0.2186000    
 C    4.186000      -1.468500      0.7081000    
 H   -1.731900       1.673300      0.1403000    
 H   0.6228000       4.107200      0.2013000    
 H  -0.6549000       3.303900     -0.6805000    
 H  -0.5402000       3.159200       1.106200    
 H    1.166700       2.079200      -2.179700    
 H    2.264600       3.149500      -1.300500    
 H    2.615500       1.431400      -1.401300    
 H    2.461700       3.026500       1.226200    
 H    1.482000       1.869800       2.145200    
 H    2.788900       1.302100       1.105000    
 H   -5.021300      -1.124000       1.400500    
 H   -3.683500      -2.251500       1.207800    
 H   -3.478900     -0.8108000       2.211100    
 H   -3.832300      -2.035700      -1.346200    
 H   -5.171000     -0.9033000      -1.194400    
 H   -3.727600     -0.4459000      -2.111400    
 H   -5.109000       1.036600      0.2768000    
 H   -3.661900       1.539500       1.134400    
 H   -3.763000       1.690200     -0.6420000    
 H   -1.890000      -2.593900     -0.2231000    
 H   0.5188000      -2.702100     -0.3951000    
 H    2.239000      -2.229100       1.067800    
 H    2.847300      -2.541000     -0.5940000    
 H    4.690000      -2.348500       1.118200    
 H    4.155200     -0.6885000       1.474200    
 H    4.997500      -1.668900      -1.053900    


%chk=000154268-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000154268

0 1
O 2.239846 -0.584308 0.346335
O 4.828550 -0.813294 -1.043876
C 1.019113 2.044589 0.176950
C -3.562133 -0.394639 -0.003167
C 0.202596 0.726331 0.178224
C -2.017091 -0.437109 0.090525
C -1.213164 0.731799 0.098489
C 0.106520 3.295597 0.064884
C 2.000112 2.068135 -1.037032
C 1.825206 2.169941 1.506795
C 0.828787 -0.557053 0.257518
C -4.177486 -1.090085 1.248904
C -4.022629 -1.150595 -1.286304
C -4.115571 1.052234 -0.070538
C -1.347614 -1.681016 0.172256
C 0.057169 -1.743290 0.255720
C 2.921508 -1.871141 0.206942
C 4.424049 -1.595287 0.127126
H -1.711487 1.700254 0.034856
H 0.739469 4.201656 0.070671
H -0.476052 3.301569 -0.875395
H -0.596245 3.374986 0.915418
H 1.441769 1.985224 -1.988700
H 2.553599 3.026625 -1.047763
H 2.733040 1.247918 -0.981255
H 2.411698 3.108379 1.501036
H 1.142680 2.195295 2.376947
H 2.521409 1.325795 1.629707
H -5.282411 -1.085768 1.186621
H -3.846944 -2.140637 1.335554
H -3.879536 -0.564874 2.174833
H -3.691557 -2.204683 -1.277912
H -5.126583 -1.141983 -1.363389
H -3.607160 -0.673332 -2.192746
H -5.219049 1.022970 -0.133365
H -3.846884 1.636745 0.828852
H -3.743758 1.592333 -0.960928
H -1.915247 -2.618758 0.174617
H 0.541232 -2.721969 0.329074
H 2.711273 -2.519768 1.084926
H 2.563675 -2.396501 -0.706386
H 4.957890 -2.570948 0.162317
H 4.741420 -0.987857 0.990065
H 4.470688 -1.238181 -1.864607


