%chk=000118365.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000118365

0 1
 O    1.935800      -1.690500     -3.9999999E-04
 O    3.072200      0.4346000      5.7999999E-03
 N   -2.444000      0.4295000     -7.8999996E-03
 C   -1.032700      0.4662000     -4.9999999E-03
 C    1.069400     -0.6409000     -2.0999999E-03
 C    1.718300      0.5726000      1.6000000E-03
 C  -0.3077000     -0.7279000     -5.5999998E-03
 C  -0.3695000       1.706000     -1.2000001E-03
 C    1.026100       1.766000      2.0999999E-03
 C   -3.187800     -0.7911000     -1.1800000E-02
 C    3.202900      -1.001500      4.0000002E-03
 C   -4.682900     -0.5231000      2.0600000E-02
 H  -0.7746000      -1.706000     -9.3999999E-03
 H  -0.9383000       2.633000     -6.9999998E-04
 H   -2.933100       1.317900     -1.2300000E-02
 H    1.541200       2.719900      5.2000000E-03
 H   -2.962700      -1.375400     -0.9119000    
 H   -2.934400      -1.399700      0.8643000    
 H    3.768400      -1.301300     -0.8858000    
 H    3.763700      -1.304100      0.8958000    
 H   -4.961200      3.8800001E-02  0.9186000    
 H   -4.995200      6.2600002E-02 -0.8506000    
 H   -5.240900      -1.464600      1.8500000E-02


%chk=000118365-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000118365

0 1
O 2.030579 -1.693370 -0.002945
O 3.162407 0.430831 0.003173
N -2.464171 0.417106 -0.001400
C -1.066410 0.453884 -0.001107
C 1.087242 -0.633619 -0.001407
C 1.745797 0.610420 0.001974
C -0.302813 -0.760739 -0.003547
C -0.392261 1.714882 0.002110
C 1.022536 1.805898 0.003464
C -3.255950 -0.813631 -0.004369
C 3.366813 -1.037648 -0.000663
C -4.759824 -0.489646 0.014194
H -0.774697 -1.745032 -0.007903
H -0.984921 2.637424 0.004029
H -2.965179 1.304232 -0.010058
H 1.526830 2.775927 0.005947
H -3.019815 -1.424555 -0.903803
H -3.000885 -1.437582 0.880376
H 3.906046 -1.327064 -0.920766
H 3.905332 -1.331939 0.918288
H -5.030659 0.084152 0.920016
H -5.049608 0.101146 -0.874866
H -5.353388 -1.420078 0.011063


