%chk=000111546.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000111546

0 1
 O    2.709500      0.6771000      -1.511000    
 C   -4.261500      -2.131900      7.5999998E-02
 C   -4.353300     -0.6961000      0.6293000    
 C   -5.632600      -2.698600     -0.2953000    
 C   -3.300600      -2.239200      -1.109500    
 C   -3.053200     -0.1070000       1.099000    
 C   -1.919400       2.014200      8.9699998E-02
 C  -0.5895000       2.517300      0.6039000    
 C   -2.495800      0.9528000      0.5880000    
 C    3.566500     -0.3616000      0.4773000    
 C   0.5651000       1.889700     -0.1262000    
 C    4.643700     -0.9539000     -0.4300000    
 C   -2.520500       2.787300      -1.050500    
 C    2.592100      0.5060000     -0.2995000    
 C    1.488200       1.131400      0.4800000    
 C    5.630200      -1.789100      0.3347000    
 C    6.931100      -1.498400      0.4442000    
 H   -3.858800      -2.770100      0.8747000    
 H   -5.046000     -0.6888000       1.480600    
 H   -4.802100     -4.5800000E-02 -0.1335000    
 H   -6.307700      -2.675400      0.5665000    
 H   -6.092900      -2.118700      -1.102400    
 H   -5.549600      -3.738700     -0.6279000    
 H   -2.280300      -1.962400     -0.8260000    
 H   -3.265100      -3.266200      -1.488800    
 H   -3.615100      -1.586900      -1.931300    
 H   -2.557800     -0.6009000       1.930000    
 H  -0.5175000       2.329900       1.683400    
 H  -0.5316000       3.606100      0.4841000    
 H    3.000200      -1.165700      0.9619000    
 H    4.029800      0.2581000       1.254200    
 H   0.6253000       2.079800      -1.195200    
 H    4.178400      -1.584600      -1.197800    
 H    5.160900     -0.1478000     -0.9660000    
 H   -2.704300       3.824500     -0.7522000    
 H   -1.847200       2.786800      -1.913400    
 H   -3.475600       2.357200      -1.371000    
 H    1.449800      0.9299000       1.544800    
 H    5.253200      -2.685500      0.8201000    
 H    7.592700      -2.145400       1.009600    
 H    7.357100     -0.6173000     -2.2900000E-02


%chk=000111546-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000111546

0 1
O 2.504469 1.308875 -1.490446
C -3.734784 -2.060050 0.485106
C -3.970915 -0.792642 -0.392151
C -3.963304 -3.340059 -0.351812
C -2.323453 -2.052533 1.116457
C -3.996181 0.501689 0.412611
C -2.245921 2.495492 0.149390
C -0.948141 2.487570 0.986421
C -3.133096 1.508194 0.279468
C 2.985567 -0.608492 -0.043248
C 0.245510 2.073883 0.156808
C 4.208773 -0.899737 -0.940010
C -2.435291 3.659526 -0.815384
C 2.197131 0.637514 -0.459623
C 1.045856 1.000570 0.417359
C 4.864467 -2.219679 -0.596951
C 6.159994 -2.382350 -0.227068
H -4.482369 -2.045232 1.307308
H -4.943651 -0.904963 -0.915209
H -3.186006 -0.735362 -1.170254
H -4.987122 -3.371558 -0.769850
H -3.250801 -3.387615 -1.198080
H -3.817493 -4.248658 0.261476
H -2.162931 -1.142976 1.723114
H -2.174113 -2.935102 1.765879
H -1.546903 -2.074186 0.326637
H -4.800277 0.581686 1.163432
H -1.059892 1.815187 1.854431
H -0.783238 3.515703 1.374235
H 2.283095 -1.470339 -0.048856
H 3.296630 -0.495115 1.015786
H 0.482000 2.670105 -0.737727
H 3.869711 -0.900790 -1.995170
H 4.936108 -0.072262 -0.854765
H -2.443930 4.622518 -0.267817
H -1.605932 3.708295 -1.547348
H -3.380093 3.570077 -1.375162
H 0.857929 0.362980 1.292869
H 4.215780 -3.108932 -0.665253
H 6.574395 -3.370886 0.001379
H 6.844224 -1.528249 -0.146384


