%chk=000153941.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000153941

0 1
 O   -3.428700       2.429200     -0.7252000    
 O   -4.153300      -1.901000       1.128800    
 O    4.266800      -1.898900     -0.3348000    
 N   6.8300001E-02 -0.2278000     -0.2869000    
 N    1.862800       1.316900      0.2676000    
 N    1.337300      -2.044300     -0.6356000    
 N    4.057100      0.3425000      0.2166000    
 N    3.713900       2.609600      0.7623000    
 C   -1.129900      0.6072000     -0.1828000    
 C   -3.553500      0.2174000      0.2321000    
 C   -3.339800       1.042300      -1.045100    
 C   -1.920700      0.7046000      -1.496300    
 C   -2.159600      0.1442000      0.8249000    
 C   -4.110700      -1.171200     -7.5099997E-02
 C    1.355400      0.1316000     -8.0200002E-02
 C   -1.901400     -0.2166000       2.089300    
 C   0.1061000      -1.561800     -0.6227000    
 C    2.120300     -0.9778000     -0.2940000    
 C    3.560900     -0.9152000     -0.1485000    
 C    3.248600       1.369300      0.4057000    
 H  -0.8076000       1.616100      0.1031000    
 H   -4.216000      0.7387000      0.9350000    
 H   -4.075500      0.8305000      -1.827500    
 H   -1.496300       1.477100      -2.147000    
 H   -1.916600     -0.2429000      -2.047400    
 H   -3.482600      -1.720100     -0.7842000    
 H   -5.120500      -1.109600     -0.4937000    
 H  -0.8873000     -0.2208000       2.474500    
 H   -2.693700     -0.4936000       2.775600    
 H   -4.337700       2.600900     -0.4259000    
 H  -0.7878000      -2.129500     -0.8438000    
 H    1.300900       2.145900      0.4292000    
 H   -4.780900      -1.456300       1.723900    
 H    3.083100       3.390800      0.9047000    
 H    4.704900       2.780100      0.8944000    


%chk=000153941-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000153941

0 1
O -3.034630 2.559675 -0.499682
O -4.882370 -1.856839 0.834140
O 4.599121 -1.674087 -0.311456
N 0.111869 -0.347092 0.044029
N 1.863365 1.441430 0.155775
N 1.509362 -2.143318 -0.233394
N 4.133046 0.615247 -0.036470
N 3.728969 2.905366 0.230145
C -1.119330 0.457542 0.080002
C -3.591923 0.222371 0.250848
C -3.187540 1.155171 -0.935019
C -1.768967 0.702712 -1.311148
C -2.262533 -0.131220 0.927030
C -4.366085 -1.026991 -0.258442
C 1.415746 0.132379 0.036601
C -2.099852 -0.845857 2.063442
C 0.233759 -1.750063 -0.134624
C 2.276744 -0.964929 -0.129294
C 3.739238 -0.765359 -0.170971
C 3.270489 1.603853 0.110183
H -0.862260 1.447508 0.509227
H -4.263116 0.765714 0.948053
H -3.903506 1.093036 -1.779601
H -1.245440 1.466137 -1.908282
H -1.799771 -0.238827 -1.888209
H -3.700724 -1.702072 -0.821789
H -5.191584 -0.702036 -0.929441
H -1.102236 -1.083073 2.451262
H -2.957995 -1.248154 2.609380
H -3.910693 2.912502 -0.202024
H -0.635018 -2.402212 -0.150659
H 1.224265 2.230400 0.265881
H -5.596558 -1.360613 1.309345
H 3.124218 3.713168 0.348784
H 4.738241 3.026031 0.197378


