%chk=000001507.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000001507

1 1
 O   -2.847100       2.017700      0.6535000    
 N  -0.5190000       1.021500     -0.3110000    
 N    5.093500      -1.756500      0.4317000    
 N    5.842300      0.3796000     -6.0500000E-02
 C    1.078400     -0.4889000      6.8999998E-02
 C   0.8458000      0.8508000     -0.2496000    
 C   -1.155300     -0.1606000     -4.2800002E-02
 C  -0.1932000      -1.114700      0.1965000    
 C   -2.594000     -0.2710000     -3.7999999E-02
 C    2.409100     -0.9349000      0.1945000    
 C    1.881500       1.770400     -0.4499000    
 C    3.455200     -2.6200000E-02 -2.7999999E-03
 C    3.193100       1.305100     -0.3201000    
 C   -3.395700      0.8176000      0.3089000    
 C   -3.185200      -1.486600     -0.3859000    
 C    4.823900     -0.4767000      0.1247000    
 C   -4.784800      0.6910000      0.3081000    
 C   -4.574300      -1.613300     -0.3867000    
 C   -5.374200     -0.5246000     -3.9700001E-02
 H  -0.3693000      -2.153500      0.4436000    
 H  -0.9741000       1.897200     -0.5302000    
 H    2.563600      -1.977400      0.4420000    
 H    1.677500       2.806900     -0.6969000    
 H    3.976400       2.037900     -0.4802000    
 H   -2.588900      -2.350500     -0.6691000    
 H   -5.420900       1.530400      0.5760000    
 H   -5.033600      -2.558900     -0.6594000    
 H   -6.455800     -0.6231000     -4.0899999E-02
 H    6.058900      -2.057600      0.5183000    
 H    4.387900      -2.463300      0.5877000    
 H    5.727700       1.356600     -0.2933000    
 H    6.797200      4.8900001E-02  3.3100002E-02
 H   -3.559600       2.646900      0.8592000    


%chk=000001507-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000001507

1 1
O -2.894192 2.147309 0.098008
N -0.500215 1.085351 0.073044
N 5.226174 -1.712830 0.529059
N 5.859458 0.267204 -0.544508
C 1.108576 -0.525287 0.007101
C 0.864312 0.907366 0.079153
C -1.157714 -0.165416 -0.003187
C -0.175936 -1.170658 -0.047740
C -2.620469 -0.271130 -0.028665
C 2.439024 -0.988872 -0.008913
C 1.915090 1.851334 0.135889
C 3.502844 -0.041536 0.039767
C 3.231197 1.370769 0.110822
C -3.486292 0.862991 0.020136
C -3.238731 -1.552401 -0.107591
C 4.887324 -0.504205 0.008472
C -4.889603 0.724562 -0.008844
C -4.635700 -1.703017 -0.136652
C -5.467623 -0.558599 -0.087069
H -0.355113 -2.241486 -0.109836
H -1.042562 1.957920 0.109605
H 2.643576 -2.059106 -0.129291
H 1.716061 2.924262 0.214370
H 4.056782 2.082529 0.221933
H -2.604849 -2.443663 -0.146912
H -5.529983 1.614781 0.029327
H -5.077566 -2.701676 -0.197756
H -6.556672 -0.662598 -0.109179
H 6.140701 -2.141935 0.382626
H 4.553186 -2.218815 1.103298
H 5.598702 1.089495 -1.087511
H 6.853887 0.056962 -0.450699
H -3.576674 2.860593 0.131545


