%chk=000003671.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000003671

0 1
 O    2.565600      0.4940000     -0.7968000    
 N   -1.710400     -0.7845000      6.4900003E-02
 N  -0.9094000      -1.883900      0.1018000    
 C   0.3696000     -3.0000000E-03 -0.1134000    
 C    1.468800      -2.336400      1.5000000E-03
 C   0.3292000      -1.401200     -5.5999998E-03
 C  -0.9479000      0.3811000     -6.6900000E-02
 C    1.488000       2.317900      0.3144000    
 C    1.502000      0.8656000     -0.2424000    
 C    1.464100      -3.323100      -1.189600    
 C    1.604900      -3.133900       1.319800    
 C   -1.631200       1.628300     -0.1217000    
 C    2.598800       2.484200       1.347100    
 C    1.637900       3.356100     -0.7996000    
 C   -3.107200     -0.7464000      0.1424000    
 C   -2.974900       1.653400     -4.6300001E-02
 C   -3.747900      0.4319000      9.0499997E-02
 H    2.403300      -1.772200     -8.6000003E-02
 H   0.5671000       2.500200      0.8681000    
 H   0.5970000      -3.991700      -1.150200    
 H    2.369300      -3.939600      -1.186800    
 H    1.426400      -2.779800      -2.140200    
 H    1.666000      -2.454500       2.177200    
 H    2.510400      -3.749800       1.309600    
 H   0.7454000      -3.795100       1.476300    
 H   -1.112700       2.563000     -0.2831000    
 H    3.589300       2.359400      0.8958000    
 H    2.504200       1.736400       2.142100    
 H    2.559500       3.476700       1.808200    
 H    1.562000       4.372100     -0.3990000    
 H    2.605300       3.259200      -1.304400    
 H   0.8599000       3.227600      -1.558900    
 H   -3.625700      -1.692000      0.2430000    
 H   -3.518300       2.589800     -0.1116000    
 H   -4.827700      0.4977000      0.1458000    


%chk=000003671-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000003671

0 1
O 2.783281 0.230519 0.152740
N -1.742393 -0.719732 0.242745
N -0.965189 -1.881182 0.315409
C 0.400666 0.017678 0.218934
C 1.461344 -2.429554 0.321513
C 0.325643 -1.429234 0.290461
C -0.962472 0.466617 0.185174
C 1.584061 2.345151 0.307648
C 1.645747 0.803594 0.228543
C 1.988405 -2.664872 -1.124188
C 1.054364 -3.762203 0.990555
C -1.682355 1.695728 0.094352
C 2.843035 2.914355 0.995975
C 1.440387 2.909664 -1.136868
C -3.118654 -0.743957 0.231680
C -3.081352 1.689124 0.080963
C -3.810602 0.458401 0.153103
H 2.288939 -1.961489 0.885355
H 0.696809 2.637992 0.901067
H 1.194370 -3.092623 -1.763865
H 2.836621 -3.373153 -1.101199
H 2.343775 -1.720080 -1.568558
H 0.693857 -3.602195 2.022525
H 1.926749 -4.440053 1.027096
H 0.246485 -4.260807 0.427344
H -1.138921 2.638903 0.027640
H 3.751676 2.571312 0.473465
H 2.914836 2.575427 2.044983
H 2.818456 4.019706 0.987347
H 1.353578 4.011561 -1.112296
H 2.336471 2.649202 -1.728542
H 0.557877 2.503073 -1.663603
H -3.575742 -1.733005 0.284531
H -3.626162 2.635529 0.010930
H -4.902889 0.448101 0.143040


