%chk=000100344.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000100344

0 1
 O   0.3229000      -1.357500      1.6000000E-03
 O    4.302200      0.1454000     -1.6200000E-02
 N   0.7634000      0.8608000      2.7000001E-03
 N    3.268400       2.176900      4.1999999E-03
 C  -0.1459000     -8.2300000E-02  1.8000000E-03
 C   -1.583600      3.7900001E-02  8.9999998E-04
 C    1.675100      -1.194200      2.4000001E-03
 C    1.938000      0.1531000      2.9000000E-03
 C   -2.380100      -1.107200     -9.9999997E-05
 C   -2.177000       1.300200       0.000000    
 C    2.493100      -2.412300      2.6000000E-03
 C   -3.770100     -0.9901000     -2.0000001E-03
 C   -3.566900       1.417400     -1.8000000E-03
 C    3.223800      0.7795000      3.8999999E-03
 C   -4.363400      0.2723000     -2.9000000E-03
 H   -1.956000      -2.108000      3.9999999E-04
 H   -1.576500       2.206600      6.0000003E-04
 H    3.127100      -2.450500     -0.8885000    
 H    3.138400      -2.442800      0.8859000    
 H    1.870700      -3.312700      1.0500000E-02
 H   -4.390700      -1.881300     -2.9000000E-03
 H   -4.029300       2.400200     -2.4999999E-03
 H   -5.445600      0.3636000     -4.4000000E-03
 H    2.425600       2.742600      1.0800000E-02
 H    4.155000       2.670100     -2.7999999E-03


%chk=000100344-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000100344

0 1
O 0.371348 -1.436199 0.000558
O 4.415689 0.179317 0.003103
N 0.765515 0.814548 0.000310
N 3.205101 2.186836 0.002205
C -0.182932 -0.120066 0.000104
C -1.634937 0.021711 -0.000374
C 1.774282 -1.256061 0.001033
C 1.998409 0.115287 0.001052
C -2.484890 -1.118110 -0.000116
C -2.205625 1.324879 -0.001086
C 2.644099 -2.464685 0.000757
C -3.884730 -0.952186 -0.000546
C -3.605250 1.480759 -0.001516
C 3.310490 0.810785 0.002300
C -4.450377 0.344646 -0.001243
H -2.042645 -2.119133 0.000415
H -1.539930 2.193802 -0.001286
H 3.299233 -2.470574 -0.887806
H 3.315271 -2.458439 0.877106
H 2.033719 -3.381822 0.011995
H -4.535612 -1.833201 -0.000334
H -4.039639 2.486300 -0.002064
H -5.538668 0.469415 -0.001571
H 2.279254 2.617441 0.001453
H 4.051426 2.752451 0.002650


