%chk=000094151.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000094151

0 1
 O   -2.568800      -3.253600      0.7799000    
 N    1.740500      0.1311000      -1.263100    
 N  -0.9611000       1.182600      0.4680000    
 C    3.099100       1.181000      0.6911000    
 C    1.095200     -0.1988000      4.2700000E-02
 C    3.974300      0.1901000     -0.1156000    
 C    1.841200      0.4653000       1.224300    
 C    2.615000       2.262200     -0.2897000    
 C    3.113800     -0.4378000      -1.239800    
 C    1.861200       1.594600      -1.449200    
 C  -0.4175000      1.4400000E-02  2.1199999E-02
 C    4.616500     -0.8520000      0.7498000    
 C   -1.429600     -0.8078000     -0.3958000    
 C   -2.653700     -0.1106000     -0.1953000    
 C   -2.331600       1.135200      0.3475000    
 C   -1.280700      -2.168900     -0.9523000    
 C    5.938700      -1.005600      0.8802000    
 C   -4.009000     -0.4207000     -0.4244000    
 C   -3.301100       2.090100      0.6740000    
 C   -1.314200      -3.275900      0.1112000    
 C   -4.989500      0.5249000     -0.1027000    
 C   -4.638700       1.760200      0.4381000    
 H    3.662200       1.635200       1.514000    
 H    1.207100      -1.284300      0.1866000    
 H    4.768200      0.7773000     -0.6000000    
 H    1.229800       1.186800       1.775200    
 H    2.123100     -0.3005000       1.956700    
 H    3.467300       2.833200     -0.6764000    
 H    1.957700       2.972000      0.2266000    
 H    3.592900     -0.2588000      -2.211700    
 H    3.054400      -1.530700      -1.151200    
 H   0.8687000       2.046400      -1.560900    
 H    2.374700       1.803700      -2.396500    
 H    3.970600      -1.539600       1.289600    
 H  -0.4504000       1.984400      0.8100000    
 H   -2.084100      -2.349600      -1.677700    
 H  -0.3423000      -2.247600      -1.514100    
 H    6.340400      -1.787500       1.515400    
 H    6.640100     -0.3613000      0.3619000    
 H   -4.301900      -1.377300     -0.8473000    
 H   -3.028900       3.052200       1.094900    
 H   -1.179200      -4.260100     -0.3480000    
 H  -0.5282000      -3.131300      0.8590000    
 H   -6.036400      0.2914000     -0.2778000    
 H   -5.416600       2.479800      0.6805000    
 H   -3.256200      -3.436900      0.1169000    


%chk=000094151-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000094151

0 1
O -2.443004 -3.485923 0.472852
N 1.651458 -0.189977 -1.085707
N -1.015530 1.174641 0.872987
C 3.124896 1.248994 0.492844
C 1.067867 -0.238921 0.309825
C 4.005403 0.113826 -0.132041
C 1.925639 0.656044 1.283787
C 2.566301 2.128125 -0.660342
C 3.036816 -0.740615 -1.051973
C 1.679087 1.217887 -1.587021
C -0.419555 0.049318 0.267031
C 4.709853 -0.738931 0.896961
C -1.418034 -0.695504 -0.376124
C -2.673387 -0.003491 -0.158050
C -2.391817 1.166242 0.633725
C -1.210250 -1.977883 -1.143342
C 6.054967 -0.845399 1.040837
C -4.014859 -0.250300 -0.555993
C -3.398481 2.069739 1.038689
C -1.196468 -3.258498 -0.272389
C -5.024114 0.648548 -0.161368
C -4.720045 1.796148 0.630963
H 3.749319 1.859059 1.170400
H 1.186982 -1.295982 0.619622
H 4.775144 0.604025 -0.761147
H 1.352895 1.502942 1.707651
H 2.275089 0.063343 2.148010
H 3.402172 2.580376 -1.227035
H 1.970723 2.960810 -0.238433
H 3.417763 -0.768983 -2.088451
H 2.981369 -1.785011 -0.691950
H 0.637554 1.579193 -1.636522
H 2.069990 1.196495 -2.619994
H 4.060182 -1.331502 1.561943
H -0.522999 1.868852 1.429077
H -2.001861 -2.085744 -1.913848
H -0.245343 -1.922350 -1.684160
H 6.504250 -1.494812 1.800580
H 6.747275 -0.285469 0.398804
H -4.265276 -1.123137 -1.171438
H -3.169529 2.952919 1.646165
H -0.966225 -4.134880 -0.917743
H -0.421698 -3.188894 0.510608
H -6.062121 0.468764 -0.463114
H -5.527831 2.475315 0.925898
H -3.211567 -3.342498 -0.135276


