%chk=000168136.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000168136

0 1
 O   -2.934300      0.3235000      0.1603000    
 O   -2.862200      -1.037600     -0.3520000    
 O  -0.1838000       3.188600     -0.6511000    
 C   0.6940000     -0.1939000      0.6738000    
 C  -0.8074000     -0.6448000      0.6384000    
 C    1.662900      -1.296100      9.5399998E-02
 C   -1.811600      0.4518000       1.044900    
 C   -1.462900      -1.238100     -0.6311000    
 C   0.8543000       1.107400     -0.1014000    
 C   -1.341900       1.899900      0.9815000    
 C    3.073100     -0.7375000     -0.1752000    
 C    1.091700      9.1300003E-02   2.153800    
 C  -0.2222000       2.144000     -2.0000001E-03
 C    3.033800      0.4377000      -1.146700    
 C    1.891200       1.375500     -0.9133000    
 C    1.783900      -2.557200      0.9614000    
 C   -1.162200     -0.5596000      -1.970200    
 C   -1.296300      -2.754800     -0.7666000    
 H  -0.9131000      -1.415600       1.417500    
 H    1.285900      -1.616800     -0.8800000    
 H   -2.192300      0.2535000       2.054300    
 H  -0.9912000       2.241200       1.960800    
 H   -2.179300       2.551300      0.7014000    
 H    3.716700      -1.520800     -0.5953000    
 H    3.550800     -0.4250000      0.7608000    
 H   0.9288000     -0.7868000       2.788000    
 H    2.144100      0.3786000       2.247100    
 H   0.5168000      0.9011000       2.607500    
 H    2.959700      6.0500000E-02  -2.173900    
 H    3.978300      0.9895000      -1.078800    
 H    1.942000       2.309800      -1.466400    
 H   0.8067000      -2.962700       1.234200    
 H    2.321200      -3.340100      0.4140000    
 H    2.344600      -2.366900       1.882200    
 H  -0.1240000     -0.6889000      -2.283500    
 H   -1.800100     -0.9784000      -2.758400    
 H   -1.392800      0.5097000      -1.950400    
 H   -1.548000      -3.265000      0.1702000    
 H   -1.991100      -3.151300      -1.517100    
 H  -0.2886000      -3.049800      -1.063400    


%chk=000168136-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000168136

0 1
O -2.942945 0.376712 0.100349
O -2.907441 -1.078783 -0.357991
O -0.133577 3.289028 -0.589404
C 0.703009 -0.190621 0.680256
C -0.798278 -0.667560 0.655772
C 1.669204 -1.293944 0.097630
C -1.814194 0.455515 1.082271
C -1.439576 -1.271304 -0.656566
C 0.853591 1.117462 -0.118675
C -1.337702 1.918788 1.005075
C 3.083818 -0.721323 -0.179893
C 1.082347 0.089410 2.172903
C -0.192582 2.184985 0.030302
C 3.046929 0.429680 -1.205899
C 1.905856 1.378007 -0.951742
C 1.780598 -2.562955 0.975768
C -1.124590 -0.558700 -1.984632
C -1.332681 -2.803252 -0.772744
H -0.885075 -1.471360 1.411219
H 1.259114 -1.596704 -0.886685
H -2.223416 0.233364 2.085888
H -1.013053 2.258599 2.008535
H -2.188060 2.565124 0.722982
H 3.739252 -1.534688 -0.546151
H 3.534099 -0.360372 0.765317
H 0.877721 -0.791835 2.807065
H 2.153441 0.339650 2.263260
H 0.516994 0.937392 2.592737
H 2.948450 0.025988 -2.238045
H 4.004061 0.988874 -1.205844
H 1.901732 2.344875 -1.475401
H 0.796217 -2.964797 1.273074
H 2.310090 -3.359756 0.420957
H 2.358407 -2.366608 1.897164
H -0.050612 -0.586193 -2.233685
H -1.683752 -1.054300 -2.797682
H -1.444372 0.495004 -1.945337
H -1.594225 -3.294328 0.180447
H -2.030046 -3.163781 -1.549343
H -0.313557 -3.108095 -1.062549


