%chk=000162202.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000162202

0 1
 O   -1.664800      0.6059000      0.7115000    
 O   -2.224400       1.921100      -1.135200    
 O   -1.624300      -1.608300     -0.9678000    
 C    4.449700      -1.036700      8.1000000E-02
 C    3.214600     -0.1208000      9.3999997E-02
 C    4.240500      -2.204800       1.069000    
 C    5.697800     -0.2319000      0.5034000    
 C    4.753400      -1.657300      -1.301500    
 C    1.010500       1.512500      0.1173000    
 C    2.861800      0.4799000       1.276200    
 C    2.521100      5.3500000E-02  -1.077200    
 C  -0.1879000       2.400000      0.1300000    
 C    1.741300       1.310500       1.288100    
 C    1.400400      0.8840000      -1.065300    
 C  -5.3700000E-02   3.620800     -0.8024000    
 C   -1.484800       1.647900     -0.1983000    
 C   -2.829200     -0.1289000      0.4773000    
 C   -2.780300      -1.222200     -0.3594000    
 C   -3.990300      0.2747000       1.100700    
 C   -3.949900      -1.947900     -0.5845000    
 C   -5.160000     -0.4511000      0.8757000    
 C   -5.139700      -1.562500      3.3100002E-02
 C  -0.8019000      -2.538600     -0.2659000    
 H    5.090000      -2.897500       1.046300    
 H    4.137000      -1.863200       2.104600    
 H    3.338500      -2.776100      0.8190000    
 H    5.623100      0.1489000       1.527800    
 H    6.600500     -0.8528000      0.4605000    
 H    5.854600      0.6290000     -0.1574000    
 H    5.642200      -2.298900      -1.252700    
 H    3.931300      -2.289700      -1.657200    
 H    4.962200     -0.8919000      -2.058200    
 H    3.414400      0.3371000       2.198500    
 H    2.776900     -0.4100000      -2.021200    
 H  -0.3392000       2.807500       1.139600    
 H    1.450300       1.792200       2.217800    
 H   0.8393000       1.024700      -1.985300    
 H  -0.9209000       4.282800     -0.7007000    
 H   0.8439000       4.199000     -0.5569000    
 H   1.3300000E-02   3.327200      -1.855900    
 H   -4.006200       1.139000       1.757300    
 H   -3.941800      -2.814400      -1.240300    
 H   -6.086400     -0.1511000       1.356700    
 H   -6.050500      -2.127500     -0.1423000    
 H   -1.339900      -3.477000     -9.8700002E-02
 H  -0.4732000      -2.117100      0.6893000    
 H   8.0700003E-02  -2.744800     -0.8777000    


%chk=000162202-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000162202

0 1
O -2.069973 0.869132 0.758146
O -1.914067 1.608928 -1.467769
O -1.566117 -1.686798 -0.480694
C 4.574312 -1.154108 -0.112340
C 3.317688 -0.253098 -0.058763
C 4.377941 -2.365580 0.849623
C 5.819782 -0.334327 0.341500
C 4.847975 -1.703892 -1.535965
C 0.985426 1.426875 0.117587
C 2.930807 0.352804 1.168361
C 2.502552 0.003331 -1.191657
C -0.240738 2.347592 0.215677
C 1.787625 1.173525 1.257021
C 1.357468 0.826440 -1.108705
C -0.039830 3.670609 -0.563677
C -1.471582 1.606229 -0.307524
C -3.149602 -0.017462 0.434097
C -2.871004 -1.286801 -0.138851
C -4.467135 0.375922 0.725776
C -3.949753 -2.146413 -0.444601
C -5.538504 -0.496748 0.428416
C -5.277755 -1.752816 -0.167044
C -0.634069 -1.877162 0.655842
H 5.276255 -3.011451 0.841714
H 4.206108 -2.036636 1.890259
H 3.510394 -2.977406 0.539726
H 5.705928 0.046876 1.371927
H 6.725328 -0.969080 0.312833
H 5.982434 0.532580 -0.324529
H 5.753746 -2.337342 -1.519605
H 4.011995 -2.326919 -1.904117
H 5.021631 -0.889222 -2.263064
H 3.528074 0.183981 2.072320
H 2.753126 -0.444986 -2.157560
H -0.420577 2.564759 1.283668
H 1.515762 1.622416 2.220595
H 0.741378 0.985348 -2.001673
H -0.904693 4.345032 -0.430683
H 0.868017 4.183868 -0.202959
H 0.072674 3.473235 -1.642888
H -4.640707 1.362476 1.167364
H -3.722588 -3.114121 -0.902925
H -6.566134 -0.191727 0.650934
H -6.105442 -2.427589 -0.410437
H -0.926065 -2.774855 1.234233
H -0.615163 -0.990872 1.312997
H 0.357070 -2.019348 0.200115


