%chk=000015083.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000015083

0 1
 O  -4.8300002E-02  0.3211000     -0.7675000    
 O    1.305400      -1.914900      0.4458000    
 N   -3.202700      0.6126000      0.5024000    
 C  -0.7448000     -0.8062000     -0.2185000    
 C   -2.052200     -0.9596000     -0.9818000    
 C   -2.900200      0.3062000     -0.8906000    
 C   0.1193000      -2.054200     -0.3427000    
 C    1.251000      0.3839000     -0.3376000    
 C    1.903400     -0.6964000      0.2603000    
 C   -3.971700     -0.4728000       1.113700    
 C   -3.936900       1.875000      0.6051000    
 C    1.926500       1.589500     -0.5292000    
 C    3.217800     -0.5583000      0.7072000    
 C    3.245300       1.722400     -9.4300002E-02
 C    3.888300      0.6518000      0.5278000    
 H  -0.9316000     -0.6034000      0.8443000    
 H   -2.599000      -1.852400     -0.6609000    
 H   -1.826500      -1.115700      -2.045700    
 H   -3.818600      0.1675000      -1.476400    
 H   -2.360600       1.142000      -1.353100    
 H  -0.4166000      -2.935100      2.5900001E-02
 H   0.4146000      -2.246400      -1.382300    
 H   -4.864900     -0.7308000      0.5331000    
 H   -4.301800     -0.1838000       2.119000    
 H   -3.369600      -1.373800       1.263500    
 H   -3.350000       2.697000      0.1802000    
 H   -4.118100       2.131600       1.654800    
 H   -4.901900       1.835300      8.6900003E-02
 H    1.430100       2.430900      -1.004900    
 H    3.728900      -1.389800       1.184900    
 H    3.771000       2.662200     -0.2363000    
 H    4.913800      0.7595000      0.8691000    


%chk=000015083-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000015083

0 1
O 0.035860 0.279393 -0.882377
O 1.381435 -1.851774 0.594942
N -3.411124 0.419707 0.543041
C -0.724505 -0.823370 -0.217942
C -2.021312 -0.987179 -1.013816
C -2.947245 0.240019 -0.853913
C 0.152482 -2.079797 -0.198096
C 1.366039 0.410012 -0.426223
C 2.017703 -0.623494 0.303098
C -4.471252 -0.531887 0.931402
C -3.791165 1.815773 0.843270
C 2.055006 1.605738 -0.716875
C 3.338264 -0.439889 0.760583
C 3.382285 1.782652 -0.269451
C 4.020710 0.763476 0.478995
H -0.958176 -0.500078 0.816060
H -2.538315 -1.907049 -0.677683
H -1.775795 -1.120268 -2.085056
H -3.805097 0.149432 -1.567655
H -2.372916 1.138065 -1.143738
H -0.359469 -2.917783 0.302084
H 0.432746 -2.371534 -1.230279
H -5.419214 -0.391586 0.351039
H -4.705132 -0.409172 2.004016
H -4.132822 -1.571682 0.780350
H -2.942671 2.487024 0.623640
H -4.033278 1.911406 1.917308
H -4.677873 2.171727 0.259520
H 1.533839 2.382969 -1.285129
H 3.812232 -1.250278 1.323488
H 3.911383 2.713661 -0.498200
H 5.046777 0.900668 0.835798


