%chk=000064892.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000064892

0 1
 O  -0.2777000       2.078100      0.3634000    
 O    2.923500      -1.358700      -1.065200    
 O    5.335600      -1.810600     -0.1131000    
 N    1.814300      0.3377000      6.2100001E-02
 N   -1.446300      0.8263000      -1.205400    
 C   0.4801000     -0.1684000     -0.1403000    
 C   2.2700001E-02  -1.072000       1.010500    
 C   -1.110200      -1.988600      0.6181000    
 C  -0.4449000       1.036700     -0.2677000    
 C   -2.428500       1.827100      -1.555700    
 C    2.940700     -0.3106000     -0.4251000    
 C   -2.418500      -1.561400      0.7830000    
 C  -0.8225000      -3.241400      9.8999999E-02
 C   -3.650800       1.742600     -0.6879000    
 C    4.245500      0.3256000     -0.1090000    
 C   -3.465700      -2.408500      0.4200000    
 C   -1.869700      -4.088300     -0.2640000    
 C   -3.191200      -3.671700     -0.1034000    
 C   -4.713900      0.9349000      -1.074600    
 C   -3.707200       2.472600      0.4936000    
 C    5.374500     -0.4559000      3.0400001E-02
 C    4.280400       1.698200      3.7099998E-02
 C   -5.849500      0.8561000     -0.2685000    
 C   -4.842800       2.393700       1.299800    
 C    6.589800      0.1607000      0.3284000    
 C    5.495700       2.314600      0.3352000    
 C   -5.913900       1.585400      0.9187000    
 C    6.650300       1.545900      0.4808000    
 H   0.4825000     -0.7274000      -1.084600    
 H   0.8620000      -1.689000       1.360000    
 H  -0.2721000     -0.4732000       1.883100    
 H    1.911300       1.153100      0.6585000    
 H   -1.511900     -7.3899999E-02  -1.671400    
 H   -1.975300       2.822800      -1.482000    
 H   -2.691700       1.675600      -2.608800    
 H   -2.643400     -0.5868000       1.204900    
 H   0.2034000      -3.573500     -3.2400001E-02
 H   -4.494700      -2.087200      0.5502000    
 H   -1.656300      -5.071800     -0.6722000    
 H   -4.006600      -4.331600     -0.3850000    
 H   -4.673100      0.3598000      -1.995500    
 H   -2.881300       3.107600      0.8007000    
 H    3.412000       2.334100     -0.1022000    
 H   -6.682800      0.2255000     -0.5643000    
 H   -4.893200       2.961700       2.224100    
 H    7.497500     -0.4256000      0.4445000    
 H    5.545000       3.394000      0.4461000    
 H   -6.797800       1.523600       1.546600    
 H    7.596900       2.026200      0.7111000    
 H    6.228800      -2.170400      2.3600001E-02


%chk=000064892-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000064892

0 1
O -0.048564 2.279984 -0.530072
O 2.817885 -1.664381 -0.439780
O 4.797826 -1.260530 1.788976
N 1.809419 0.404949 -0.161199
N -1.671547 0.774649 -1.264189
C 0.478983 -0.123081 -0.453673
C -0.083173 -0.993851 0.736855
C -1.084676 -2.045061 0.284073
C -0.431949 1.085013 -0.758044
C -2.703465 1.802872 -1.516856
C 2.918331 -0.418370 -0.196391
C -2.468982 -1.945120 0.580764
C -0.623684 -3.162829 -0.465065
C -3.797151 1.817133 -0.452018
C 4.235087 0.284208 0.022333
C -3.374841 -2.940054 0.141298
C -1.527141 -4.154910 -0.904019
C -2.906852 -4.046726 -0.603373
C -5.132296 1.473389 -0.774137
C -3.480857 2.173438 0.885415
C 5.183297 -0.193222 0.968319
C 4.581358 1.404926 -0.773077
C -6.138533 1.481448 0.220674
C -4.482628 2.181372 1.879813
C 6.448778 0.429742 1.093929
C 5.841586 2.031797 -0.654429
C -5.815541 1.834050 1.550450
C 6.777397 1.535581 0.280855
H 0.552894 -0.785893 -1.337790
H 0.795653 -1.496055 1.176977
H -0.516780 -0.328074 1.505437
H 1.865507 1.412762 0.028446
H -1.946309 -0.210825 -1.317103
H -2.167535 2.768426 -1.539399
H -3.142364 1.626180 -2.515852
H -2.838811 -1.091993 1.163576
H 0.448881 -3.248977 -0.681840
H -4.439790 -2.850218 0.383930
H -1.156718 -5.015095 -1.473187
H -3.606871 -4.819427 -0.940783
H -5.388037 1.199128 -1.805580
H -2.450780 2.454850 1.135654
H 3.859466 1.771297 -1.512128
H -7.168634 1.215034 -0.041667
H -4.229188 2.464671 2.907655
H 7.171357 0.054905 1.830929
H 6.090744 2.889344 -1.287134
H -6.593381 1.842701 2.322182
H 7.760445 2.007944 0.382760
H 5.541186 -1.533403 2.382683


