%chk=000154236.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000154236

0 1
 O   0.3179000     -0.7516000      8.7499999E-02
 O   -5.623000      0.6643000     -0.1178000    
 O    2.636400      -2.085400      0.2851000    
 O   -7.196200      -1.001600      0.1769000    
 N    1.548500     -7.1199998E-02  2.2000000E-03
 C   -2.065600     -0.5285000      3.1700000E-02
 C   -3.239500      0.4351000     -0.1025000    
 C  -0.7303000      0.1963000     -5.8899999E-02
 C   -4.574600     -0.2833000      3.0999999E-02
 C    3.970400     -0.1680000      4.0300000E-02
 C    2.661400     -0.8675000      0.1275000    
 C   -6.893700      0.1672000     -2.2100000E-02
 C    5.071300     -0.8704000     -0.4025000    
 C    4.040300       1.160200      0.4044000    
 C    6.299400     -0.2143000     -0.4848000    
 C    5.268500       1.816300      0.3220000    
 C    6.398100       1.128900     -0.1225000    
 C   -7.889300       1.273600     -0.1974000    
 H   -2.121600      -1.064200      0.9876000    
 H   -2.115400      -1.299600     -0.7472000    
 H   -3.175200       1.221800      0.6597000    
 H   -3.198000      0.9511000      -1.069800    
 H  -0.6416000      0.6957000      -1.031500    
 H  -0.6575000      0.9486000      0.7360000    
 H   -4.665800      -1.052400     -0.7452000    
 H   -4.648500     -0.7580000       1.016600    
 H    1.525700      0.9250000     -0.1844000    
 H    5.010000      -1.914800     -0.6931000    
 H    3.191000       1.719800      0.7822000    
 H    7.178800     -0.7490000     -0.8318000    
 H    5.347500       2.860500      0.6103000    
 H    7.354600       1.639500     -0.1852000    
 H   -7.769800       1.726300      -1.184800    
 H   -7.754300       2.021200      0.5883000    
 H   -8.901500      0.8663000     -0.1208000    


%chk=000154236-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000154236

0 1
O 0.318779 -0.368636 -1.355558
O -5.577094 0.468444 0.352119
O 1.727869 -0.918655 1.007909
O -7.202331 -0.900021 -0.606203
N 1.645277 0.122214 -1.081282
C -2.039014 -0.267979 -0.884036
C -3.194194 0.399179 -0.099406
C -0.690143 0.355280 -0.520123
C -4.537362 -0.244033 -0.446379
C 3.759950 0.121433 0.138352
C 2.310622 -0.286365 0.076671
C -6.895097 0.028701 0.174319
C 4.613186 -0.640570 0.977055
C 4.289624 1.227685 -0.577880
C 5.982432 -0.319322 1.077227
C 5.661030 1.548883 -0.472746
C 6.511340 0.772879 0.348473
C -7.840663 0.830190 1.042819
H -1.999478 -1.350914 -0.660184
H -2.207566 -0.165432 -1.973744
H -3.018707 0.306595 0.989207
H -3.240316 1.480955 -0.329641
H -0.649525 1.435282 -0.765250
H -0.440251 0.197981 0.544389
H -4.785933 -0.144664 -1.519463
H -4.565454 -1.318406 -0.186192
H 2.140275 0.348985 -1.947389
H 4.178735 -1.471268 1.542697
H 3.633671 1.866808 -1.180391
H 6.636455 -0.915177 1.723040
H 6.062891 2.409141 -1.019214
H 7.574671 1.024194 0.429012
H -7.769317 1.903173 0.794142
H -7.564686 0.721172 2.105942
H -8.871276 0.480168 0.888707


