%chk=000005394.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000005394

0 1
 O    2.649800       1.685200      3.1999999E-03
 O   -2.812600      -1.697600      1.1400000E-02
 N   0.5864000      0.7933000      6.9999998E-04
 N    2.338100     -0.6593000     -6.9999998E-04
 N   -1.468500       1.644800       0.000000    
 N   0.2231000      -1.529900     -2.4000001E-03
 N    1.461000      -1.725100     -2.4000001E-03
 N   -3.961800      0.2869000     -4.3000001E-03
 C  -0.2632000     -0.2747000     -1.3000000E-03
 C   -1.525400      0.2747000     -1.9000000E-03
 C    1.962600      0.6761000      1.3000000E-03
 C  -0.1841000       1.927100      1.6000000E-03
 C    3.759000     -0.9581000     -1.2000001E-03
 C   -2.764400     -0.4433000     -3.8999999E-03
 H   0.2405000       2.921800      3.1999999E-03
 H    4.370300     -5.1899999E-02  9.9999997E-05
 H    3.990800      -1.545000     -0.8948000    
 H    3.990800      -1.547600      0.8906000    
 H   -3.972000       1.301900     -8.9999996E-03
 H   -4.860100     -0.1847000      3.9999999E-04


%chk=000005394-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000005394

0 1
O 2.750402 1.732302 0.000286
O -3.006557 -1.786807 -0.000182
N 0.572903 0.823994 -0.000402
N 2.399615 -0.612787 -0.000430
N -1.539431 1.597304 -0.000349
N 0.239918 -1.611950 -0.001185
N 1.538465 -1.789589 -0.001044
N -3.980702 0.344678 -0.000958
C -0.283725 -0.326653 -0.000763
C -1.592544 0.194225 -0.000847
C 1.996674 0.732827 -0.000197
C -0.238672 1.949091 -0.000341
C 3.833142 -0.962205 -0.000192
C -2.906909 -0.525761 -0.001107
H 0.160007 2.959388 -0.000057
H 4.416482 -0.030382 0.000062
H 4.069523 -1.554500 -0.898316
H 4.069167 -1.554766 0.897852
H -3.812762 1.352523 -0.000934
H -4.924696 -0.036335 -0.000296


