%chk=000010316.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000010316

0 1
 O  -1.2000001E-03   1.267400       1.078000    
 N   0.3823000      0.3325000      0.2934000    
 N  -0.3907000     -0.4419000     -0.3732000    
 C    1.810600      0.1147000      0.1119000    
 C   -1.772100     -0.2724000     -0.2394000    
 C    2.257200      -1.156500     -0.1808000    
 C    2.667800       1.187300      0.2370000    
 C   -2.454000      0.5961000      -1.091700    
 C   -2.468300     -0.9718000      0.7463000    
 C    3.625200      -1.365000     -0.3564000    
 C    4.035800      0.9789000      6.1200000E-02
 C    4.514400     -0.2973000     -0.2354000    
 C   -3.832200      0.7652000     -0.9582000    
 C   -3.846400     -0.8029000      0.8798000    
 C   -4.528400      6.5700002E-02  2.7500000E-02
 H    1.586600      -2.006000     -0.2681000    
 H    2.312000       2.188700      0.4595000    
 H   -1.920200       1.145300      -1.862900    
 H   -1.945600      -1.651000       1.414800    
 H    3.998500      -2.359100     -0.5847000    
 H    4.728400       1.810400      0.1536000    
 H    5.579600     -0.4596000     -0.3719000    
 H   -4.363100       1.441500      -1.621700    
 H   -4.388600      -1.347500       1.647300    
 H   -5.601400      0.1973000      0.1315000    


%chk=000010316-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000010316

0 1
O 0.188587 0.666857 1.788168
N 0.451745 0.200076 0.578626
N -0.415843 -0.161732 -0.352790
C 1.873472 0.058557 0.206764
C -1.811759 -0.081383 -0.132021
C 2.243714 -0.437284 -1.064320
C 2.839409 0.435061 1.165034
C -2.563076 -0.518366 -1.268196
C -2.511968 0.362618 1.035913
C 3.614469 -0.555684 -1.373302
C 4.206971 0.310858 0.839702
C 4.598733 -0.183351 -0.426184
C -3.967665 -0.515482 -1.247615
C -3.923197 0.358274 1.038009
C -4.657237 -0.075268 -0.090150
H 1.465437 -0.717198 -1.776866
H 2.504395 0.812415 2.134152
H -2.007177 -0.853544 -2.149619
H -1.951100 0.697551 1.907499
H 3.914959 -0.938971 -2.354272
H 4.965184 0.600171 1.574978
H 5.661524 -0.278027 -0.673819
H -4.526944 -0.853701 -2.126515
H -4.453785 0.698926 1.934220
H -5.752647 -0.071371 -0.069997


