%chk=000145398.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000145398

0 1
 O    2.258500      -1.899000     -0.4170000    
 O   -2.683400     -0.7142000     -0.7165000    
 O   -2.843700      0.2848000       1.360300    
 C  -0.7583000      0.2970000      0.1517000    
 C    1.526900     -0.6942000     -0.2412000    
 C   0.9011000       1.489000      -1.333600    
 C    1.285200       1.387100       1.159100    
 C   3.6499999E-02  -1.010700     -2.3399999E-02
 C  -0.5872000       1.164100      -1.111600    
 C  -0.2048000       1.064400       1.369400    
 C    1.684600      0.1769000      -1.500400    
 C    2.064600      7.4800000E-02  0.9776000    
 C    1.441400       2.246900     -0.1078000    
 C   -2.208800     -2.8800000E-02  0.3624000    
 C    2.149600      -2.747100      0.7187000    
 C   -4.062300      -1.091000     -0.6477000    
 H    1.016000       2.106600      -2.231200    
 H    1.672500       1.933200       2.026400    
 H  -0.1395000      -1.620500      0.8697000    
 H  -0.3367000      -1.609500     -0.8651000    
 H  -0.9795000      0.6520000      -1.999700    
 H   -1.162900       2.094100      -1.015300    
 H  -0.7647000       1.996300       1.524100    
 H  -0.3275000      0.4738000       2.287100    
 H    1.331900     -0.3706000      -2.384100    
 H    2.746600      0.3850000      -1.684600    
 H    3.137200      0.2749000      0.8586000    
 H    1.961800     -0.4856000       1.912100    
 H    2.498000       2.499300     -0.2602000    
 H   0.9018000       3.194200      1.4000000E-02
 H    1.140400      -3.124800      0.8899000    
 H    2.596400      -2.333000       1.623700    
 H    2.749100      -3.635500      0.4876000    
 H   -4.694900     -0.2010000     -0.5772000    
 H   -4.231200      -1.754600      0.2056000    
 H   -4.314000      -1.628700      -1.565700    


%chk=000145398-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000145398

0 1
O 2.313197 -1.923407 -0.433783
O -2.788956 -0.705814 -0.737860
O -2.978294 0.338584 1.328333
C -0.785254 0.323760 0.150781
C 1.528159 -0.692068 -0.173269
C 0.926608 1.478368 -1.335023
C 1.256720 1.435021 1.171821
C 0.021289 -1.011729 0.015107
C -0.582039 1.167931 -1.150568
C -0.249605 1.122764 1.371090
C 1.716399 0.148665 -1.456374
C 2.052409 0.103922 1.048486
C 1.450520 2.280535 -0.114870
C -2.269657 0.014272 0.346673
C 2.377531 -2.902512 0.651856
C -4.226875 -1.052605 -0.648290
H 1.062197 2.070087 -2.261110
H 1.627001 2.000057 2.049257
H -0.134775 -1.621128 0.927079
H -0.344427 -1.592289 -0.850599
H -0.971878 0.606653 -2.019419
H -1.157797 2.111693 -1.074722
H -0.827642 2.058474 1.487232
H -0.405189 0.537670 2.297369
H 1.368227 -0.442017 -2.324801
H 2.795904 0.343792 -1.599580
H 3.133235 0.305476 0.917057
H 1.928250 -0.482300 1.980260
H 2.522492 2.524569 -0.253243
H 0.903150 3.239937 -0.025036
H 1.376833 -3.285699 0.938169
H 2.880953 -2.499410 1.553865
H 2.976559 -3.737228 0.253133
H -4.839161 -0.136030 -0.603350
H -4.420130 -1.657805 0.253486
H -4.435256 -1.624588 -1.563457


