%chk=000043367.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000043367

0 1
 O   -2.465200      -2.460400     -0.2082000    
 O    4.726200     -0.5805000      -1.214700    
 O   -3.826600       2.029200     -0.2149000    
 N   0.2935000      -1.395000      0.2481000    
 N   -1.567600       1.568800      0.1001000    
 N   -3.170400     -0.2193000     -0.2167000    
 N    2.543200     -0.8029000      0.6069000    
 N   0.7438000      0.7824000      0.4100000    
 C  -0.8988000     -0.7462000      9.9399999E-02
 C  -0.5948000      0.5838000      0.2024000    
 C    1.252200     -0.4325000      0.4325000    
 C   -2.211200      -1.262200     -0.1189000    
 C    3.655000      0.1234000      0.8108000    
 C   -2.917900       1.196600     -0.1169000    
 C    4.257600      0.5712000     -0.5164000    
 C   0.5017000      -2.825600      0.2176000    
 C   -1.194800       2.973200      0.2168000    
 C   -4.554700     -0.6228000     -0.4416000    
 C    5.428700       1.518900     -0.2963000    
 H    4.413500     -0.4059000       1.400200    
 H    3.329300      0.9857000       1.404600    
 H    2.820300      -1.779000      0.5554000    
 H    3.503500       1.059700      -1.143500    
 H    1.299100      -3.101700      0.9112000    
 H  -0.3999000      -3.345300      0.5429000    
 H   0.7623000      -3.110100     -0.8045000    
 H   -2.063100       3.629000      0.1145000    
 H  -0.4741000       3.216300     -0.5701000    
 H  -0.7400000       3.139900       1.198000    
 H   -4.675000      -1.706000     -0.5131000    
 H   -4.907800     -0.1583000      -1.367900    
 H   -5.166300     -0.2451000      0.3841000    
 H    5.114200       2.424600      0.2307000    
 H    6.224700       1.033800      0.2794000    
 H    5.868800       1.808300      -1.256700    
 H    3.962100      -1.164400      -1.359500    


%chk=000043367-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000043367

0 1
O -2.668176 -2.494493 -0.103589
O 4.709060 -0.254567 -1.423560
O -3.677133 2.116113 -0.273562
N 0.306030 -1.594542 0.261459
N -1.425470 1.515651 0.014920
N -3.147035 -0.166212 -0.185296
N 2.647161 -0.992355 0.542749
N 0.865088 0.637039 0.310125
C -0.893975 -0.857284 0.105063
C -0.503486 0.489215 0.140817
C 1.321765 -0.651914 0.381394
C -2.247148 -1.290548 -0.061801
C 3.670244 0.041931 0.805067
C -2.800732 1.211184 -0.154913
C 4.147739 0.741610 -0.489770
C 0.432649 -3.057229 0.298659
C -0.990583 2.924273 0.055619
C -4.587908 -0.455565 -0.363287
C 5.263507 1.749155 -0.209265
H 4.535472 -0.455503 1.279310
H 3.260182 0.796632 1.501672
H 2.880620 -1.968187 0.719982
H 3.276616 1.249813 -0.952270
H 0.834800 -3.396714 1.272018
H -0.574152 -3.484039 0.164323
H 1.086233 -3.418448 -0.517273
H -1.887489 3.550916 -0.054649
H -0.281516 3.126682 -0.764818
H -0.490533 3.138813 1.015038
H -4.700190 -1.549542 -0.380749
H -4.949457 -0.012840 -1.305785
H -5.167971 -0.020104 0.466982
H 4.918502 2.533520 0.488149
H 6.142247 1.241393 0.227695
H 5.581274 2.230083 -1.149225
H 3.985265 -0.892338 -1.655529


