%chk=000226783.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000226783

0 1
 O   0.6128000      -1.791700       1.466800    
 O   -1.907200      -2.013500      0.4139000    
 N   -4.245900       1.999500     -0.4649000    
 C    1.965200     -0.2792000      0.2878000    
 C    2.451600     -0.6968000     -0.9511000    
 C    2.711800      0.6028000       1.068800    
 C    4.431200      0.6498000     -0.6277000    
 C    3.684700     -0.2323000      -1.408800    
 C    3.944800       1.067300      0.6112000    
 C   0.6752000     -0.7651000      0.7666000    
 C  -0.6021000      1.6100001E-02  0.4285000    
 C    1.674800      -1.640900      -1.810000    
 C    2.216700       1.068300       2.399700    
 C    5.749700       1.146300      -1.117000    
 C   -1.882800     -0.7909000      0.2968000    
 C   -3.149500     -7.0500001E-02 -1.8100001E-02
 C   -4.318300     -0.7760000     -0.1419000    
 C   -3.133800       1.285900     -0.1796000    
 C   -5.483900     -7.6700002E-02 -0.4352000    
 C   -5.395100       1.297700     -0.5857000    
 H    4.067300     -0.5528000      -2.375000    
 H    4.529400       1.757400       1.215000    
 H  -0.4276000      0.5336000     -0.5217000    
 H  -0.7322000      0.7477000       1.233500    
 H    2.226600      -1.915700      -2.715800    
 H   0.7326000      -1.183500      -2.128700    
 H    1.462800      -2.569600      -1.269900    
 H    1.974000      0.2175000       3.044800    
 H    2.970800       1.662000       2.928300    
 H    1.330200       1.698700       2.279000    
 H    5.614000       2.067000      -1.693000    
 H    6.429600       1.351000     -0.2830000    
 H    6.240500      0.4027000      -1.754200    
 H   -4.366300      -1.853200     -1.9600000E-02
 H   -2.245600       1.899500     -9.4499998E-02
 H   -6.432000     -0.5911000     -0.5425000    
 H   -6.275300       1.889300     -0.8148000    


%chk=000226783-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000226783

0 1
O 0.341377 -0.414033 2.170372
O -1.504582 -1.815781 -0.030373
N -4.831037 1.688843 -0.500925
C 1.943069 0.080044 0.420153
C 2.262031 -0.368016 -0.903465
C 2.971080 0.643984 1.251493
C 4.602311 0.380544 -0.594036
C 3.586752 -0.217307 -1.375991
C 4.270787 0.797738 0.717215
C 0.555542 -0.038598 0.983178
C -0.650041 0.461509 0.155466
C 1.258579 -1.073193 -1.807351
C 2.721286 1.092624 2.682350
C 6.003388 0.572623 -1.144299
C -1.766583 -0.579590 -0.010214
C -3.182216 -0.107863 -0.193050
C -4.218477 -1.078868 -0.270511
C -3.548183 1.259966 -0.316617
C -5.547134 -0.654136 -0.454084
C -5.807002 0.734374 -0.562299
H 3.832001 -0.588250 -2.379345
H 5.048341 1.246812 1.347789
H -0.343022 0.815381 -0.845681
H -1.038787 1.342891 0.700005
H 1.787870 -1.739818 -2.509900
H 0.684639 -0.355246 -2.427066
H 0.536266 -1.685172 -1.242710
H 2.577997 0.223544 3.347197
H 3.574886 1.685788 3.052816
H 1.805263 1.702053 2.781276
H 6.109223 1.569495 -1.615421
H 6.764645 0.505773 -0.347252
H 6.243513 -0.181207 -1.914200
H -3.950814 -2.136804 -0.182553
H -2.796671 2.056567 -0.278205
H -6.369821 -1.373246 -0.512091
H -6.827777 1.107175 -0.703670


