%chk=000163994.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000163994

0 1
 O   0.5081000      -2.280300     -1.9000000E-03
 N   -1.941600     -0.3792000     -1.9999999E-04
 N   -1.748900       1.841400     -1.1000000E-03
 N   0.6811000       1.914800     -8.9999998E-04
 N    1.734900     -0.2855000      3.0000001E-04
 N    3.008200       1.680600      2.6000000E-03
 C  -0.5999000     -0.1236000       0.000000    
 C  -0.5059000       1.261700     -6.0000003E-04
 C   0.5356000     -0.9095000      3.9999999E-04
 C   -2.588600      0.8283000     -7.9999998E-04
 C   -2.582300      -1.672900      3.5000001E-03
 C    1.733800       1.069000     -3.0000001E-04
 C    1.765500      -2.945000     -1.1000000E-03
 H   -3.667300      0.9089000     -3.9999999E-04
 H   -3.667600      -1.543500      5.4000001E-03
 H   -2.275800      -2.213200     -0.8956000    
 H   -2.272400      -2.210000      0.9034000    
 H    1.578000      -4.022700     -2.2000000E-03
 H    2.336400      -2.700900      0.9010000    
 H    2.338500      -2.699300     -0.9014000    
 H    3.075000       2.689000      2.4999999E-03
 H    3.836700       1.101800      3.3000000E-03


%chk=000163994-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000163994

0 1
O 0.510391 -2.264524 0.000327
N -1.982712 -0.399398 0.000663
N -1.767423 1.896255 0.000670
N 0.711208 1.964406 0.000704
N 1.782185 -0.258726 0.000511
N 3.042463 1.717471 0.000709
C -0.606315 -0.123847 0.000859
C -0.488214 1.311096 0.000781
C 0.587332 -0.879893 0.000620
C -2.613858 0.846572 0.000743
C -2.628499 -1.717625 0.001562
C 1.794658 1.132463 0.000634
C 1.792547 -2.997497 0.000083
H -3.699486 0.933293 0.000653
H -3.722198 -1.576788 0.002506
H -2.337936 -2.294109 -0.892813
H -2.336334 -2.293569 0.895756
H 1.502239 -4.058434 0.000401
H 2.383739 -2.744871 0.896822
H 2.383147 -2.745286 -0.897167
H 3.103453 2.731718 0.000627
H 3.871113 1.131192 0.000250


