%chk=000019918.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000019918

0 1
 O   -2.480100      -1.652500      0.2727000    
 O   -3.210900       1.026000      0.1534000    
 N    3.121100      0.6461000      0.1045000    
 N    1.375000       2.305700      4.3600000E-02
 C   0.7979000     -1.9300001E-02  0.1601000    
 C    2.162100     -0.2972000      0.1593000    
 C   0.4428000       1.338200      9.9200003E-02
 C    2.672600      -1.701200      0.2207000    
 C  -0.1854000      -1.022300      0.2179000    
 C   -1.533100     -0.6764000      0.2155000    
 C  -0.9133000       1.655800      9.8099999E-02
 C   -1.897200      0.6642000      0.1554000    
 C    2.854900      -2.310000      -1.165700    
 C    2.663200       1.907200      4.9600001E-02
 C   -2.019300      -3.001400      0.3321000    
 C   -3.850300       1.137200      -1.116400    
 H    3.656900      -1.685600      0.7089000    
 H    2.067100      -2.348000      0.8629000    
 H   0.1289000      -2.056500      0.2467000    
 H   -1.217200       2.700500      5.2700002E-02
 H    3.538400      -1.709300      -1.775500    
 H    1.901500      -2.379400      -1.699700    
 H    3.271600      -3.318700      -1.083200    
 H    3.409200       2.691400      4.6000001E-03
 H   -1.472400      -3.281900     -0.5746000    
 H   -2.906500      -3.641800      0.3764000    
 H   -1.445200      -3.193300       1.245000    
 H   -3.365800       1.908700      -1.723400    
 H   -4.892200       1.425200     -0.9514000    
 H   -3.831600      0.1777000      -1.642900    


%chk=000019918-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000019918

0 1
O -2.554323 -1.453144 0.050927
O -3.127520 1.318909 -0.011144
N 3.263641 0.670551 0.279426
N 1.547980 2.408863 0.169250
C 0.919283 0.011829 0.152698
C 2.325097 -0.309969 0.235900
C 0.573341 1.416140 0.127088
C 2.837902 -1.736733 0.241050
C -0.128777 -0.960832 0.108671
C -1.469422 -0.566982 0.040151
C -0.797171 1.798456 0.039241
C -1.813485 0.843879 -0.014337
C 2.914959 -2.332454 -1.192071
C 2.821574 1.980893 0.239683
C -2.261694 -2.883521 0.192870
C -4.096868 0.771997 -0.986515
H 3.848560 -1.721823 0.682783
H 2.201466 -2.378695 0.879705
H 0.128728 -2.022222 0.148826
H -1.053937 2.860168 0.014659
H 3.590140 -1.726511 -1.820996
H 1.923061 -2.352304 -1.679056
H 3.306460 -3.365162 -1.161566
H 3.603353 2.746582 0.272798
H -1.671988 -3.258798 -0.665514
H -3.244403 -3.376203 0.213700
H -1.720599 -3.084466 1.137075
H -3.727690 0.925393 -2.018456
H -5.011088 1.362623 -0.826065
H -4.283881 -0.297363 -0.804281


