%chk=000172844.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000172844

0 1
 O   -1.534500     -0.3512000     -0.8842000    
 O   -1.750700      0.3710000       1.367400    
 C   0.4400000      0.5337000      0.2821000    
 C    1.732800       1.396200      0.1473000    
 C   0.8550000     -0.8765000      0.8176000    
 C  -0.3172000      0.3791000      -1.063300    
 C  -0.5568000       1.153200       1.291800    
 C    2.757300      0.7353000     -0.7985000    
 C    2.060500      -1.481300      0.1397000    
 C    1.508700       2.847400     -0.2929000    
 C    2.905500     -0.7418000     -0.5964000    
 C   -2.374600      0.2774000      8.5100003E-02
 C    2.267500      -2.952900      0.3448000    
 C   -3.623700     -0.5733000      0.2379000    
 C   -4.369600     -0.7162000      -1.078200    
 H    2.195500       1.444400       1.144800    
 H   1.1700000E-02  -1.572600      0.7299000    
 H    1.086300     -0.8086000       1.889500    
 H  -0.5679000       1.351700      -1.501100    
 H   0.2749000     -0.1646000      -1.805300    
 H  -0.1219000       1.196900       2.296300    
 H  -0.8406000       2.175000       1.017500    
 H    3.735800       1.207000     -0.6439000    
 H    2.486500      0.9139000      -1.846500    
 H    1.044200       2.909200      -1.281300    
 H   0.8829000       3.393400      0.4182000    
 H    2.465300       3.379500     -0.3476000    
 H    3.755400      -1.214200      -1.081900    
 H   -2.655100       1.281000     -0.2621000    
 H    2.362200      -3.176900       1.412200    
 H    3.172200      -3.316600     -0.1537000    
 H    1.417600      -3.515300     -5.5000000E-02
 H   -4.282700     -0.1349000      0.9966000    
 H   -3.352700      -1.572100      0.6025000    
 H   -4.647700      0.2630000      -1.481100    
 H   -3.769600      -1.240600      -1.828500    
 H   -5.288700      -1.291800     -0.9275000    


%chk=000172844-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000172844

0 1
O -1.516814 -0.435747 -0.883356
O -1.780797 0.364860 1.377853
C 0.472584 0.517960 0.298257
C 1.756791 1.406082 0.151237
C 0.894922 -0.870765 0.858141
C -0.260948 0.327532 -1.059818
C -0.547854 1.174559 1.265136
C 2.760546 0.752472 -0.837713
C 2.094861 -1.486231 0.151395
C 1.514384 2.884886 -0.238914
C 2.927165 -0.739019 -0.624768
C -2.409777 0.236810 0.061372
C 2.303318 -2.972079 0.368678
C -3.673963 -0.600441 0.212449
C -4.485679 -0.685577 -1.096461
H 2.238160 1.400672 1.153662
H 0.031369 -1.559239 0.792530
H 1.118145 -0.775455 1.943133
H -0.499206 1.311762 -1.519096
H 0.337174 -0.271421 -1.763759
H -0.146444 1.244147 2.290820
H -0.826066 2.191554 0.913684
H 3.743202 1.256003 -0.729436
H 2.443362 0.956558 -1.884755
H 0.978268 2.977459 -1.201879
H 0.940715 3.437784 0.525919
H 2.485274 3.402151 -0.355641
H 3.772473 -1.225071 -1.132896
H -2.617785 1.266356 -0.328321
H 2.387392 -3.207140 1.448713
H 3.216453 -3.338069 -0.132544
H 1.441149 -3.554001 -0.013002
H -4.278537 -0.151487 1.021779
H -3.370045 -1.608742 0.548213
H -4.823463 0.315355 -1.426025
H -3.873712 -1.122510 -1.903784
H -5.382818 -1.315068 -0.958599


