%chk=000121497.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000121497

0 1
 O    4.321500      -2.236300     -0.1519000    
 O   0.3565000      -1.453100      0.4486000    
 O   -5.352500      0.3705000      -1.412300    
 O   -5.593000      0.5185000      0.7647000    
 N    2.169700       1.473900      6.7000002E-02
 N   -4.899300      0.2574000     -0.2477000    
 C    2.646100     -0.9372000      1.9800000E-02
 C    3.799800      -1.146700     -0.9462000    
 C    3.191200      -2.155300      0.7461000    
 C    2.731400      0.3536000      0.8208000    
 C    1.279500      -1.122400     -0.5837000    
 C    2.899400       1.663900      -1.186000    
 C    2.202700       2.696800      0.8684000    
 C    2.323300       2.827600      -1.979000    
 C    1.394600       2.530500       2.146900    
 C  -0.9354000      -1.032200      0.2775000    
 C   -1.454000     -0.9038000      -1.006400    
 C   -1.717300     -0.7382000       1.389300    
 C   -2.770300     -0.4764000      -1.180800    
 C   -3.033600     -0.3110000       1.215000    
 C   -3.560100     -0.1800000     -7.0100002E-02
 H    4.562100     -0.3672000      -1.023400    
 H    3.542700      -1.492900      -1.952900    
 H    2.589800      -3.068800      0.6953000    
 H    3.516700      -2.000800       1.779700    
 H    3.765700      0.5585000       1.130400    
 H    2.159300      0.1852000       1.739800    
 H    1.289500      -1.973000      -1.278800    
 H   0.9662000     -0.2523000      -1.168400    
 H    2.788700      0.8145000      -1.861200    
 H    3.968800       1.841800      -1.018300    
 H    1.726900       3.526600      0.3364000    
 H    3.227500       3.003000       1.112700    
 H    1.231200       2.774100      -2.046700    
 H    2.610900       3.799900      -1.567200    
 H    2.713000       2.800600      -3.003300    
 H   0.4126000       2.085300       1.953200    
 H    1.222100       3.513300       2.600400    
 H    1.917400       1.931200       2.898600    
 H  -0.8881000      -1.160000      -1.896900    
 H   -1.310100     -0.8380000       2.391500    
 H   -3.149700     -0.3934000      -2.196100    
 H   -3.619100     -8.8200003E-02   2.103400    


%chk=000121497-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000121497

0 1
O 3.680426 -2.789765 -0.530275
O 0.320627 -0.882328 0.605072
O -5.834234 -0.262522 -1.015908
O -5.979636 -0.380292 1.259903
N 2.664623 1.645182 -0.017026
N -5.300029 -0.376723 0.158016
C 2.643143 -0.901373 -0.065339
C 3.631704 -1.422035 -1.164126
C 2.971847 -2.230533 0.685825
C 3.000368 0.392859 0.704763
C 1.206091 -0.863020 -0.586550
C 3.702773 2.046344 -1.007734
C 2.279062 2.750741 0.906906
C 3.166442 2.982286 -2.108215
C 0.848878 2.602553 1.459014
C -1.048517 -0.754907 0.413480
C -1.671033 -0.631899 -0.859370
C -1.834593 -0.756860 1.599085
C -3.069369 -0.508496 -0.939497
C -3.227559 -0.634336 1.519823
C -3.836169 -0.509104 0.246257
H 4.629504 -0.944316 -1.136768
H 3.263105 -1.473448 -2.205040
H 2.117239 -2.859740 0.983782
H 3.675617 -2.108344 1.531879
H 4.081197 0.349629 0.989650
H 2.421096 0.376413 1.645632
H 0.982785 -1.748784 -1.213800
H 1.042868 0.079474 -1.144052
H 4.080976 1.127646 -1.490706
H 4.583351 2.520587 -0.504319
H 2.341915 3.698663 0.343833
H 3.005819 2.838440 1.752908
H 2.316099 2.511014 -2.631998
H 2.820906 3.949813 -1.702871
H 3.960526 3.197417 -2.847032
H 0.115136 2.617857 0.634116
H 0.616451 3.431655 2.153073
H 0.714605 1.653550 2.008091
H -1.079471 -0.632519 -1.778041
H -1.327787 -0.856872 2.563145
H -3.577961 -0.411656 -1.902390
H -3.854523 -0.632750 2.415003


