%chk=000165832.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000165832

0 1
 O   0.3572000       2.590200     -2.3000001E-03
 O  -0.9054000      -2.601800     -1.0000000E-03
 N    2.899600       2.074600      2.0000001E-03
 N   -3.462700      -2.078800      1.5000000E-03
 C    1.135000      0.3499000     -3.9999999E-04
 C   0.7840000      -1.001700     -6.9999998E-04
 C   -1.680400     -0.3618000     -1.9999999E-04
 C   -1.329400      0.9898000     -3.9999999E-04
 C   9.1100000E-02   1.395000     -8.9999998E-04
 C  -0.6364000      -1.407000     -8.9999998E-04
 C    2.485000      0.7207000      1.9999999E-04
 C    3.477400     -0.2599000      3.9999999E-04
 C    1.783100      -1.982500     -6.0000003E-04
 C   -3.030400     -0.7326000      3.9999999E-04
 C    3.127200      -1.608600     -9.9999997E-05
 C   -2.328400       1.970700     -9.9999997E-05
 C   -4.022900      0.2481000      1.0000000E-03
 C   -3.672600       1.596800      6.9999998E-04
 C    4.929100      9.8899998E-02  1.3000000E-03
 H    1.538500      -3.041300     -7.9999998E-04
 H    3.888400      -2.384400       0.000000    
 H   -2.084300       3.029600     -3.0000001E-04
 H   -5.075900     -2.2900000E-02  1.8000000E-03
 H   -4.447000       2.358500      1.1000000E-03
 H    5.185200      0.6757000     -0.8937000    
 H    5.184300      0.6749000      0.8971000    
 H    5.567300     -0.7919000      1.2000001E-03
 H    3.878500       2.323800      6.0000003E-04
 H    2.215700       2.818000      6.0000003E-04
 H   -2.795300      -2.836800     -7.9999998E-04
 H   -4.452000      -2.290400      3.9999999E-04


%chk=000165832-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000165832

0 1
O 0.364559 2.680247 0.001101
O -0.938565 -2.699883 -0.000174
N 2.899399 2.075458 0.000097
N -3.483774 -2.090695 -0.000278
C 1.131329 0.385319 -0.000103
C 0.771024 -1.002748 -0.000206
C -1.701349 -0.405233 -0.000218
C -1.345012 0.983607 -0.000007
C 0.086766 1.415377 -0.000291
C -0.657166 -1.435952 -0.000518
C 2.530467 0.750022 0.000206
C 3.540891 -0.280812 0.000496
C 1.767675 -1.995458 0.000036
C -3.101637 -0.769676 -0.000022
C 3.134420 -1.625233 0.000410
C -2.336537 1.983875 0.000464
C -4.087524 0.270055 0.000433
C -3.705754 1.617894 0.000676
C 5.006239 0.102273 0.000829
H 1.457533 -3.043652 -0.000046
H 3.903573 -2.406605 0.000615
H -2.019718 3.029932 0.000619
H -5.148922 -0.005923 0.000589
H -4.476777 2.396147 0.001027
H 5.275251 0.701947 -0.892367
H 5.274844 0.701917 0.894166
H 5.648297 -0.793518 0.000952
H 3.879256 2.345610 0.000255
H 2.126541 2.764607 -0.000706
H -2.722877 -2.791154 -0.000777
H -4.468953 -2.344947 -0.000158


