%chk=000171552.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000171552

0 1
 O  -0.2393000      0.8044000      -1.853400    
 N   0.3944000      0.4249000      0.3722000    
 C   -1.804000       1.330300     -8.7099999E-02
 C   -2.535400      0.1837000      0.6445000    
 C   -2.910700      -1.006200     -0.2469000    
 C   -1.640600       2.567500      0.8134000    
 C   -3.691900      -2.059500      0.5410000    
 C  -0.4627000      0.8320000     -0.6465000    
 C  -0.9755000       3.730500      8.6400002E-02
 C   -4.037500      -3.260200     -0.3254000    
 C    1.706400     -8.9299999E-02  0.2430000    
 C    2.410700     -0.4434000       1.381800    
 C    2.258000     -0.2288000      -1.019700    
 C    3.703600     -0.9512000       1.254300    
 C    3.550800     -0.7367000      -1.147300    
 C    4.273600      -1.097900     -1.0300000E-02
 H   -2.415700       1.622500     -0.9519000    
 H   -1.945300     -0.1764000       1.495700    
 H   -3.461000      0.5909000       1.073200    
 H   -3.514300     -0.6555000      -1.092500    
 H   -2.004000      -1.461700     -0.6616000    
 H   -2.630100       2.893600       1.156600    
 H   -1.060900       2.330200       1.712600    
 H   -3.100300      -2.396600       1.400200    
 H   -4.616100      -1.621000      0.9346000    
 H   5.5399999E-02   3.493700     -0.1940000    
 H   -1.529200       3.995200     -0.8201000    
 H  -0.9491000       4.611700      0.7355000    
 H   -4.654500      -2.962800      -1.179400    
 H   -3.131900      -3.742500     -0.7068000    
 H   -4.596600      -3.999400      0.2568000    
 H   6.7100003E-02  0.5039000       1.331400    
 H    1.976000     -0.3336000       2.371400    
 H    1.766400      2.8100001E-02  -1.945900    
 H    4.266500      -1.232500       2.139600    
 H    3.996200     -0.8512000      -2.131400    
 H    5.280300      -1.493200     -0.1096000    


%chk=000171552-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000171552

0 1
O -0.267548 0.832990 -1.879797
N 0.409479 0.439011 0.332498
C -1.848708 1.358926 -0.063281
C -2.626122 0.230064 0.673959
C -2.920023 -1.007505 -0.202542
C -1.672421 2.615744 0.837209
C -3.728337 -2.093553 0.543360
C -0.506908 0.858947 -0.635334
C -0.971259 3.793122 0.127299
C -4.027206 -3.326548 -0.336169
C 1.722766 -0.086790 0.165733
C 2.441052 -0.435366 1.342661
C 2.328077 -0.272576 -1.107003
C 3.744396 -0.962981 1.252541
C 3.634679 -0.802759 -1.178675
C 4.351676 -1.150932 -0.011318
H -2.429753 1.653738 -0.957843
H -2.070717 -0.086205 1.583810
H -3.583137 0.657636 1.037414
H -3.476162 -0.689613 -1.108041
H -1.968262 -1.445201 -0.565631
H -2.678825 2.931911 1.177412
H -1.112609 2.349175 1.759472
H -3.167002 -2.410458 1.446486
H -4.681161 -1.656471 0.906948
H 0.053202 3.522902 -0.186864
H -1.527188 4.093309 -0.779729
H -0.901682 4.672531 0.792804
H -4.609902 -3.041904 -1.232348
H -3.090599 -3.801022 -0.684122
H -4.607194 -4.087976 0.216893
H 0.092377 0.516661 1.302412
H 1.977464 -0.292730 2.328001
H 1.772367 -0.001463 -2.006139
H 4.284646 -1.226907 2.168500
H 4.094707 -0.943347 -2.163407
H 5.364637 -1.560862 -0.082767


