%chk=000059041.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000059041

0 1
 O   -2.460600     -0.9493000     -0.5277000    
 O   -1.486000     -3.1399999E-02  -2.383200    
 C  -0.6136000      0.4922000     -0.1566000    
 C   -1.475000      0.3798000       1.104600    
 C   -2.223500     -0.9181000      0.8843000    
 C  -0.3898000       1.957700     -0.5504000    
 C   -1.539300     -0.1632000      -1.168800    
 C   0.7183000     -0.2586000     -2.1500001E-02
 C   -3.543900     -0.9818000       1.628800    
 C    1.238000     -0.9506000      -1.113000    
 C    1.402300     -0.2447000       1.191800    
 C   0.4937000       2.658700      0.4360000    
 C    2.448300      -1.632800     -0.9905000    
 C    2.612900     -0.9268000       1.314200    
 C    3.135800      -1.620900      0.2230000    
 C    1.682400       3.189700      0.1288000    
 H   -2.201400       1.205400       1.124000    
 H  -0.9759000      0.3994000       2.074500    
 H   -1.609300      -1.788000       1.145400    
 H   -1.344400       2.495500     -0.6190000    
 H   5.3700000E-02   2.012500      -1.554200    
 H   -4.213200     -0.1717000       1.319000    
 H   -4.063000      -1.918700       1.399800    
 H   -3.392100     -0.9206000       2.710400    
 H   0.7485000     -0.9706000      -2.079900    
 H    1.052900      0.3015000       2.060500    
 H   0.1283000       2.768300       1.453900    
 H    2.858600      -2.169300      -1.841100    
 H    3.152300     -0.9124000       2.256800    
 H    4.079700      -2.149700      0.3176000    
 H    2.268400       3.698800      0.8862000    
 H    2.091600       3.124900     -0.8733000    


%chk=000059041-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000059041

0 1
O -2.465928 -1.063923 -0.416462
O -1.490576 -0.266889 -2.362782
C -0.605427 0.469946 -0.118874
C -1.496044 0.464769 1.152741
C -2.260471 -0.873828 1.069292
C -0.331546 1.909968 -0.671198
C -1.522237 -0.294518 -1.120716
C 0.720176 -0.322916 0.016185
C -3.624829 -0.914661 1.747527
C 1.403754 -0.721687 -1.164427
C 1.312547 -0.621667 1.268201
C 0.421619 2.790285 0.302494
C 2.640295 -1.396764 -1.092884
C 2.551733 -1.299098 1.341572
C 3.222323 -1.689776 0.162254
C 1.630780 3.355200 0.064316
H -2.221732 1.298603 1.093035
H -0.944363 0.569034 2.099026
H -1.621369 -1.715240 1.398727
H -1.313018 2.370656 -0.908394
H 0.220320 1.826170 -1.623614
H -4.277969 -0.114915 1.356823
H -4.121325 -1.884494 1.575242
H -3.508043 -0.773138 2.837884
H 0.956663 -0.514557 -2.143447
H 0.827389 -0.321270 2.202410
H -0.076756 2.987035 1.265273
H 3.146389 -1.698104 -2.016828
H 2.991889 -1.517128 2.321324
H 4.182010 -2.215260 0.219493
H 2.122307 3.996761 0.804406
H 2.166140 3.186606 -0.878197


