%chk=000074219.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000074219

0 1
 O    2.537300      -1.654800     -9.9999997E-05
 O    2.851500      0.5179000     -3.9999999E-04
 N   0.9883000       2.140800      6.9999998E-04
 N    2.096200     -0.4820000       0.000000    
 C   -1.242000       1.176100     -3.9999999E-04
 C   0.1425000       1.005700     -1.9999999E-04
 C   -1.536900      -1.221900     -1.9999999E-04
 C   0.6872000     -0.2783000      1.9999999E-04
 C   -2.081600      6.2199999E-02 -3.9999999E-04
 C  -0.1525000      -1.392100      3.0000001E-04
 C   -1.855200       2.538800      1.9999999E-04
 C   -2.434900      -2.412500      3.9999999E-04
 H   -3.161600      0.1900000     -2.4999999E-03
 H   0.2437000      -2.405000     -1.5000000E-03
 H   -1.557000       3.094900      0.8951000    
 H   -1.556600       3.095900     -0.8941000    
 H   -2.949800       2.492300     -9.9999997E-05
 H   -2.600100      -2.758700      -1.024700    
 H   -2.000900      -3.231700      0.5837000    
 H   -3.405900      -2.179200      0.4505000    
 H   0.5924000       3.070800     -6.0000003E-04
 H    1.993200       2.055300     -6.9999998E-04


%chk=000074219-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000074219

0 1
O 2.566909 -1.740957 0.090132
O 2.969569 0.499674 0.065840
N 0.971079 2.186290 0.003962
N 2.137915 -0.521009 0.064400
C -1.266042 1.206520 -0.025984
C 0.171167 1.066442 0.004019
C -1.538871 -1.267245 0.002568
C 0.704625 -0.270613 0.033040
C -2.070565 0.060495 -0.026131
C -0.147898 -1.409634 0.032060
C -1.874553 2.595399 -0.056998
C -2.466359 -2.468055 0.000568
H -3.160622 0.189577 -0.049200
H 0.324840 -2.395121 0.055021
H -1.592141 3.191189 0.834458
H -1.557792 3.166083 -0.953287
H -2.975021 2.540456 -0.077249
H -3.104288 -2.483782 -0.903502
H -1.899550 -3.413716 0.027361
H -3.143269 -2.456691 0.875857
H 0.560853 3.115755 -0.017129
H 1.987316 2.033443 0.025394


