%chk=000116766.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000116766

0 1
 O    1.722600     -0.6280000     -0.3599000    
 O    2.526700      0.4702000       1.503600    
 C   -1.570600      -2.449200      0.1718000    
 C   -2.442600      -1.359400      0.8296000    
 C   -3.129000     -0.3958000     -0.1455000    
 C   -4.007800      0.6113000      0.6058000    
 C  -0.3091000      -1.914000     -0.5289000    
 C   -4.670800       1.653700     -0.3138000    
 C   -2.384300      -3.301900     -0.8074000    
 C   0.5884000      -1.074400      0.3736000    
 C   -3.596400       2.407600      -1.101700    
 C   -5.536900       2.649200      0.4592000    
 C    2.614400      0.1395000      0.3331000    
 C    3.702000      0.5169000     -0.6008000    
 C    4.973300      0.7831000     -0.2499000    
 C    5.978500       1.155600      -1.309600    
 C    5.541800      0.7354000       1.140800    
 H   -1.237300      -3.114200      0.9804000    
 H   -1.858000     -0.7951000       1.564300    
 H   -3.224600      -1.866000       1.412000    
 H   -3.754300     -0.9427000     -0.8587000    
 H   -2.350200      0.1202000     -0.7132000    
 H   -3.401700       1.127900       1.361400    
 H   -4.790500      6.8899997E-02   1.151200    
 H  -0.5829000      -1.320800      -1.410800    
 H   0.2777000      -2.754800     -0.9218000    
 H   -5.318000       1.130400      -1.029100    
 H   -3.303900      -3.667500     -0.3388000    
 H   -1.804200      -4.175900      -1.123600    
 H   -2.653700      -2.744900      -1.710300    
 H   0.9191000      -1.672300       1.230900    
 H   5.1899999E-02 -0.1917000      0.7357000    
 H   -4.038800       3.247500      -1.649400    
 H   -2.822200       2.812200     -0.4410000    
 H   -3.118300       1.769500      -1.850700    
 H   -6.025300       3.354700     -0.2212000    
 H   -6.319900       2.125600       1.017600    
 H   -4.938200       3.223800       1.174000    
 H    3.418800      0.5514000      -1.650600    
 H    6.405700       2.140800      -1.095000    
 H    5.535500       1.198000      -2.310300    
 H    6.790900      0.4221000      -1.337500    
 H    4.885400      0.2485000       1.864400    
 H    5.753500       1.749100       1.495800    
 H    6.479200      0.1681000       1.145000    


%chk=000116766-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000116766

0 1
O 1.767283 -0.878705 -0.415540
O 2.570311 0.191216 1.496099
C -1.648451 -2.558621 0.082785
C -2.524812 -1.472185 0.775465
C -3.063550 -0.350133 -0.143490
C -3.934725 0.668170 0.628983
C -0.380896 -1.985924 -0.611078
C -4.595733 1.761809 -0.253639
C -2.467804 -3.403208 -0.922739
C 0.529761 -1.213688 0.344560
C -3.547899 2.667855 -0.944469
C -5.577476 2.614308 0.585291
C 2.742687 -0.150480 0.294565
C 3.897111 0.097708 -0.591861
C 5.046182 0.771809 -0.265631
C 6.141648 0.936322 -1.301959
C 5.330905 1.389961 1.086597
H -1.302705 -3.244603 0.887351
H -1.950598 -1.006983 1.603544
H -3.386714 -1.980500 1.256121
H -3.667546 -0.789609 -0.963128
H -2.217657 0.179240 -0.623922
H -3.318471 1.161612 1.411149
H -4.734050 0.115527 1.167070
H -0.670149 -1.329645 -1.453793
H 0.199105 -2.822759 -1.046132
H -5.179896 1.245920 -1.046797
H -3.370346 -3.825545 -0.442838
H -1.866787 -4.244007 -1.316474
H -2.796779 -2.796007 -1.786426
H 0.811163 -1.816297 1.229391
H 0.078499 -0.271527 0.704735
H -4.041242 3.449797 -1.551814
H -2.915975 3.175545 -0.189504
H -2.881294 2.094733 -1.613953
H -6.084814 3.372836 -0.039717
H -6.355301 1.984469 1.056724
H -5.039686 3.148400 1.392730
H 3.782047 -0.314486 -1.600554
H 6.358400 2.009399 -1.471097
H 5.877578 0.477369 -2.269307
H 7.085481 0.479310 -0.944685
H 4.509113 1.227455 1.797800
H 5.504157 2.478850 0.974480
H 6.265824 0.967895 1.505808


