%chk=000100189.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000100189

0 1
 O   -3.053800       3.467400      0.6749000    
 N    1.827700      -1.143100      1.6899999E-02
 C  -0.9454000     -0.9869000       1.123200    
 C  -0.4517000      -2.148900      0.2048000    
 C   0.3161000     -0.3625000       1.785400    
 C   0.7039000      -1.716900     -0.7319000    
 C   -1.610100      -2.746000     -0.6026000    
 C   -1.810200      1.5200000E-02  0.3412000    
 C    1.395100      3.2499999E-02  0.7778000    
 C   -2.279900      -1.711500      -1.498400    
 C   -1.832700      -1.544800       2.264600    
 C   -2.450600     -0.3542000     -0.8626000    
 C    2.923200     -0.7940000     -0.8875000    
 C   -2.046000       1.309800      0.8448000    
 C   -3.254600      0.5792000      -1.543000    
 C   -2.852400       2.222700      0.1624000    
 C   -3.453200       1.859300      -1.034800    
 C    4.109600     -0.2695000     -0.1332000    
 C    4.700000      0.9365000     -0.2388000    
 C    5.891300       1.399300      0.5512000    
 C    4.173600       1.956600      -1.214500    
 H  -5.5700000E-02  -2.949700      0.8471000    
 H   0.7536000      -1.095600       2.479500    
 H   6.8800002E-02  0.5043000       2.407200    
 H    1.049000      -2.605800      -1.275800    
 H   0.3549000      -1.000300      -1.485200    
 H   -2.355200      -3.171800      7.9599999E-02
 H   -1.257300      -3.584300      -1.215800    
 H    1.028800      0.8273000      0.1154000    
 H    2.218000      0.4549000       1.365200    
 H   -3.260100      -2.100000      -1.802100    
 H   -1.689300      -1.587200      -2.414700    
 H   -2.078000     -0.7639000       2.994800    
 H   -2.784600      -1.942600       1.896300    
 H   -1.322000      -2.349000       2.806500    
 H    3.260200      -1.702800      -1.403500    
 H    2.582800     -0.1147000      -1.674700    
 H   -1.613600       1.623900       1.790800    
 H   -3.733500      0.3048000      -2.480500    
 H   -4.081800       2.558200      -1.579300    
 H    4.539000     -0.9696000      0.5836000    
 H   -3.636700       3.964900      7.5800002E-02
 H    5.632300       2.270700       1.161000    
 H    6.254900      0.6163000       1.224600    
 H    6.712200       1.670800     -0.1203000    
 H    3.107800       1.855200      -1.430400    
 H    4.294200       2.966500     -0.8053000    
 H    4.734900       1.905800      -2.152800    


%chk=000100189-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000100189

0 1
O -3.361466 3.384097 0.790758
N 1.758959 -0.901105 0.011456
C -1.023598 -0.979018 1.137874
C -0.441781 -2.094914 0.205936
C 0.186503 -0.259928 1.810784
C 0.655411 -1.546256 -0.738821
C -1.561647 -2.794322 -0.598258
C -1.942840 -0.024941 0.338101
C 1.239444 0.238866 0.808000
C -2.311903 -1.803083 -1.516304
C -1.882528 -1.613024 2.276235
C -2.587876 -0.449662 -0.864681
C 2.880962 -0.508232 -0.883509
C -2.238207 1.262479 0.850917
C -3.494300 0.431825 -1.503762
C -3.141042 2.123073 0.196932
C -3.782557 1.713600 -0.994824
C 4.120142 -0.133036 -0.097434
C 4.965271 0.917646 -0.304255
C 6.195823 1.106319 0.570046
C 4.795379 1.968290 -1.388872
H 0.047859 -2.840342 0.865394
H 0.675786 -0.989518 2.485376
H -0.155302 0.579981 2.443514
H 1.075274 -2.389642 -1.321364
H 0.201708 -0.830001 -1.471785
H -2.274381 -3.267458 0.102803
H -1.133230 -3.613752 -1.208424
H 0.793412 1.025646 0.145048
H 2.086998 0.703131 1.343746
H -3.265878 -2.253246 -1.854048
H -1.717252 -1.635718 -2.438151
H -2.195432 -0.834704 2.996480
H -2.799458 -2.089620 1.888988
H -1.295977 -2.374378 2.825478
H 3.109085 -1.391984 -1.516087
H 2.581831 0.312611 -1.582902
H -1.775166 1.624333 1.773045
H -3.988070 0.102946 -2.427091
H -4.491088 2.374203 -1.511366
H 4.345839 -0.834644 0.719626
H -4.009268 3.909768 0.259325
H 6.170977 2.088497 1.083389
H 6.278387 0.317857 1.337868
H 7.122679 1.091888 -0.038144
H 3.837828 1.882165 -1.927752
H 4.857693 2.986112 -0.955746
H 5.610494 1.893697 -2.136638


