%chk=000058378.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000058378

0 1
 O    2.664900      -2.681500     -0.7024000    
 N    1.767100      -1.090500      0.7576000    
 C  -0.2231000     -4.3000001E-03 -0.1139000    
 C   -2.154900      0.6901000       1.372800    
 C   -2.284900       1.079200      -1.113700    
 C   -2.421200      -1.264000     -0.1962000    
 C  -0.6252000      0.5606000       1.269100    
 C  -0.7548000      0.9486000      -1.210600    
 C  -0.8907000      -1.388100     -0.2958000    
 C   -2.658700       1.636000      0.2700000    
 C   -2.794200     -0.6954000       1.183000    
 C   -2.923600     -0.3083000      -1.291000    
 C    1.299300     -0.1318000     -0.2135000    
 C    1.969400       1.234200     -2.3600001E-02
 C    3.494900       1.155700     -0.1370000    
 C    2.401300      -2.266200      0.4188000    
 C    4.134600       2.525900      2.6200000E-02
 H   -2.427200       1.090800       2.355800    
 H   -2.649100       1.755400      -1.895300    
 H   -2.881500      -2.249700     -0.3267000    
 H  -0.2085000       1.557300       1.444400    
 H  -0.2764000     -8.2099997E-02   2.085600    
 H  -0.4766000      0.5795000      -2.206000    
 H  -0.3438000       1.958400      -1.117000    
 H  -0.5552000      -2.099400      0.4686000    
 H  -0.6186000      -1.816800      -1.269000    
 H   -3.747000       1.751800      0.3450000    
 H   -2.223200       2.633900      0.4033000    
 H   -2.455200      -1.376200       1.973500    
 H   -3.884800     -0.6201000       1.274200    
 H   -4.016400     -0.2262000      -1.243700    
 H   -2.677200     -0.7105000      -2.281400    
 H    1.559900     -0.5008000      -1.214200    
 H    1.755000       1.653900      0.9640000    
 H    1.631900       1.954600     -0.7730000    
 H    1.659800     -0.8782000       1.744900    
 H    3.904100      0.4881000      0.6296000    
 H    3.774400      0.7420000      -1.112900    
 H    2.672200      -2.833800       1.324300    
 H    3.782900       3.218300     -0.7453000    
 H    3.901000       2.954500       1.006000    
 H    5.223000       2.447900     -5.9200000E-02


%chk=000058378-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000058378

0 1
O 2.409096 -2.699465 -0.848364
N 1.858411 -1.104786 0.784438
C -0.249652 0.042010 -0.039366
C -2.285560 0.738060 1.342906
C -2.330160 1.015127 -1.178137
C -2.431663 -1.297622 -0.161016
C -0.733673 0.657037 1.308579
C -0.779093 0.929805 -1.209432
C -0.882385 -1.375129 -0.195503
C -2.781196 1.632562 0.173921
C -2.885706 -0.685004 1.192421
C -2.933646 -0.405786 -1.327108
C 1.317979 -0.063734 -0.123370
C 2.075726 1.265932 0.137137
C 3.558352 1.219095 -0.296998
C 2.363337 -2.314776 0.354534
C 4.319570 2.515440 0.053158
H -2.606299 1.177782 2.308526
H -2.674051 1.657391 -2.013243
H -2.848738 -2.318723 -0.266140
H -0.310021 1.672367 1.442201
H -0.378875 0.037724 2.160232
H -0.444494 0.501087 -2.176765
H -0.361161 1.953976 -1.143316
H -0.527114 -2.034995 0.619533
H -0.538970 -1.829978 -1.145920
H -3.886175 1.715627 0.203701
H -2.373006 2.658465 0.279716
H -2.552539 -1.329471 2.031247
H -3.992329 -0.635974 1.237154
H -4.040974 -0.351599 -1.319414
H -2.632929 -0.846409 -2.298739
H 1.563583 -0.422415 -1.143050
H 2.019587 1.521968 1.216513
H 1.569103 2.088707 -0.401856
H 1.876537 -0.901653 1.787079
H 4.055157 0.353218 0.183009
H 3.610723 1.037354 -1.389132
H 2.740689 -2.936735 1.200567
H 3.857078 3.395005 -0.433727
H 4.315584 2.697271 1.144927
H 5.373599 2.464042 -0.275601


