%chk=000142748.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000142748

0 1
 O   -4.746800      0.1654000       2.063300    
 C   -2.145300      -1.059100     -0.9730000    
 C   0.7804000     -0.3090000     -0.2376000    
 C   -1.119700     -0.4983000      -1.987100    
 C   0.3364000     -0.8350000      -1.647000    
 C   -1.701400     -0.7532000      0.4497000    
 C  -0.2309000     -0.9609000      0.7729000    
 C   -3.509600     -0.3877000      -1.277000    
 C   -2.276700      -2.588400      -1.144600    
 C   -4.545400     -0.6218000     -0.1884000    
 C    2.204200     -0.7972000      0.1559000    
 C   0.7947000       1.242800     -0.2395000    
 C   -2.549500     -0.3467000       1.410100    
 C   -4.004800     -0.2137000       1.158900    
 C    2.744900     -0.4376000       1.388200    
 C    1.660800       1.928400      -1.088900    
 C    2.933300      -1.591900     -0.7258000    
 C  -5.8499999E-02   1.946300      0.6084000    
 C    4.021600     -0.8752000       1.740700    
 C    1.673700       3.323200      -1.090400    
 C    4.209800      -2.029700     -0.3732000    
 C  -4.5699999E-02   3.341200      0.6067000    
 C    4.754000      -1.671400      0.8601000    
 C   0.8203000       4.029700     -0.2426000    
 H   -1.216600      0.5926000      -2.061300    
 H   -1.344700     -0.8834000      -2.990500    
 H   0.4429000      -1.925500      -1.701500    
 H   0.9712000     -0.4241000      -2.442400    
 H  -1.8900000E-02 -0.6300000       1.798600    
 H  -5.7999998E-02  -2.047400      0.7922000    
 H   -3.903700     -0.7381000      -2.239200    
 H   -3.369900      0.6980000      -1.379300    
 H   -2.622400      -2.840900      -2.153600    
 H   -1.326300      -3.108200     -0.9863000    
 H   -2.991500      -3.017800     -0.4338000    
 H   -4.853400      -1.670700     -0.1390000    
 H   -5.433000     -1.6500000E-02 -0.4034000    
 H   -2.212800     -0.1410000       2.420800    
 H    2.194500      0.1828000       2.089600    
 H    2.335300       1.400300      -1.756900    
 H    2.571400      -1.892700      -1.701700    
 H  -0.7083000       1.481500       1.332300    
 H    4.445800     -0.5956000       2.700600    
 H    2.348800       3.859500      -1.750700    
 H    4.782100      -2.647100      -1.059600    
 H  -0.6999000       3.892000       1.276300    
 H    5.748300      -2.011400       1.134400    
 H   0.8328000       5.115600     -0.2415000    


%chk=000142748-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000142748

0 1
O -4.845412 -0.182037 2.232729
C -2.166315 -1.021194 -0.996316
C 0.772876 -0.297042 -0.270877
C -1.136523 -0.395548 -1.989669
C 0.326238 -0.777547 -1.687891
C -1.706903 -0.774726 0.446940
C -0.226789 -0.938246 0.758664
C -3.554187 -0.357476 -1.231986
C -2.263130 -2.562433 -1.235090
C -4.592751 -0.706417 -0.146138
C 2.192564 -0.801611 0.103570
C 0.780877 1.253508 -0.242820
C -2.600169 -0.498291 1.452164
C -4.063194 -0.430090 1.262844
C 2.793956 -0.322065 1.299263
C 1.700827 1.939193 -1.083254
C 2.913053 -1.747192 -0.668718
C -0.069599 2.031130 0.581194
C 4.060878 -0.778279 1.716190
C 1.758664 3.347143 -1.112156
C 4.188062 -2.203993 -0.257230
C -0.012010 3.445693 0.560227
C 4.766481 -1.726900 0.938425
C 0.897751 4.111515 -0.288116
H -1.235803 0.707224 -1.964450
H -1.400690 -0.717639 -3.016473
H 0.437345 -1.876860 -1.753320
H 0.988143 -0.343441 -2.460434
H -0.014898 -0.580653 1.782834
H 0.003903 -2.024728 0.765578
H -3.933243 -0.651305 -2.230431
H -3.415298 0.742044 -1.250640
H -2.578602 -2.759598 -2.276887
H -1.295583 -3.068785 -1.072644
H -2.997728 -3.031077 -0.557100
H -4.868106 -1.779809 -0.194698
H -5.531319 -0.140297 -0.281943
H -2.251169 -0.333022 2.480736
H 2.270984 0.434169 1.896947
H 2.394128 1.359884 -1.705216
H 2.496364 -2.132867 -1.604028
H -0.791696 1.547887 1.244237
H 4.501497 -0.390889 2.641835
H 2.479032 3.849051 -1.768174
H 4.727341 -2.931753 -0.874581
H -0.681404 4.022600 1.208589
H 5.753109 -2.081314 1.257010
H 0.941948 5.206182 -0.304795


