%chk=000145249.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000145249

0 1
 O   -6.264800     -0.1673000     -0.6246000    
 O  -0.7639000       1.865700       1.814700    
 O   0.4523000     -0.1725000      -1.653200    
 N   0.4859000     -0.9862000       1.278200    
 C   -2.417100      0.6471000      0.6195000    
 C   0.1107000      7.3200002E-02  0.6281000    
 C   -1.036500      0.9379000       1.066600    
 C    2.064200       1.229800     -0.6096000    
 C   0.8907000      0.3714000     -0.6333000    
 C   -2.639700     -0.4352000     -0.2108000    
 C   -3.447700       1.464500       1.044100    
 C   -4.995200      0.1021000     -0.2152000    
 C   -3.940700     -0.7103000     -0.6320000    
 C   -4.748600       1.189400      0.6229000    
 C    1.550700      -1.764500      0.7944000    
 C    2.490200       1.796000      0.5919000    
 C    2.763700       1.487300      -1.788500    
 C    3.615700       2.619800      0.6145000    
 C    3.889300       2.310900      -1.766000    
 C    2.852400      -1.479800       1.195400    
 C    1.296100      -2.814600     -8.2300000E-02
 C    4.315200       2.877100     -0.5644000    
 C    3.909700      -2.252500      0.7151000    
 C    2.353300      -3.587600     -0.5625000    
 C    3.660100      -3.306300     -0.1639000    
 C   -6.446100      -1.295400      -1.479200    
 H   -1.846300      -1.093200     -0.5479000    
 H   -3.274900       2.315400       1.696300    
 H   -4.061800      -1.571300      -1.280500    
 H   -5.566200       1.825500      0.9511000    
 H    1.972300       1.623000       1.530100    
 H    2.449500       1.055900      -2.735300    
 H    3.947500       3.061100       1.549900    
 H    4.434300       2.511300      -2.683800    
 H    3.058300     -0.6810000       1.901600    
 H   0.2811000      -3.041600     -0.3971000    
 H    5.191600       3.518300     -0.5469000    
 H    4.926500      -2.037300       1.030300    
 H    2.158900      -4.408400      -1.246600    
 H    4.483100      -3.908900     -0.5368000    
 H   -6.168300      -2.228700     -0.9778000    
 H   -5.924300      -1.165500      -2.433400    
 H   -7.515300      -1.360500      -1.706000    


%chk=000145249-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000145249

0 1
O -6.320856 -0.055083 -0.425366
O -0.557711 1.740157 1.853327
O 0.305079 -0.038661 -1.965741
N 0.670451 -1.022113 1.182519
C -2.278443 0.558855 0.621322
C 0.247856 -0.030336 0.450759
C -0.887013 0.826849 1.034173
C 1.951542 1.387491 -0.892862
C 0.823329 0.420942 -0.899719
C -2.592776 -0.428899 -0.349492
C -3.336964 1.315735 1.209607
C -4.966596 0.091786 -0.131345
C -3.926492 -0.666286 -0.731069
C -4.665858 1.086180 0.842556
C 1.744719 -1.897420 0.846504
C 2.416255 1.967017 0.320023
C 2.565262 1.738324 -2.128375
C 3.486602 2.885122 0.292042
C 3.635985 2.650183 -2.148498
C 2.632093 -2.243966 1.902183
C 1.902145 -2.507594 -0.430592
C 4.099333 3.224064 -0.937025
C 3.694584 -3.139559 1.669805
C 2.951344 -3.428274 -0.642028
C 3.858671 -3.738724 0.397044
C -6.706635 -1.059379 -1.425252
H -1.787357 -0.998661 -0.825271
H -3.081276 2.076283 1.954486
H -4.144964 -1.427330 -1.485231
H -5.492264 1.651790 1.282733
H 1.923453 1.722108 1.267956
H 2.184709 1.282712 -3.048715
H 3.840865 3.337812 1.224014
H 4.112496 2.917735 -3.097740
H 2.470024 -1.796797 2.888093
H 1.194948 -2.285204 -1.235575
H 4.933599 3.934572 -0.953873
H 4.384586 -3.384916 2.484765
H 3.059126 -3.903549 -1.623555
H 4.674154 -4.449179 0.223262
H -6.407359 -2.075368 -1.105366
H -6.262397 -0.829671 -2.412220
H -7.802350 -0.994646 -1.485165


