%chk=000059056.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000059056

0 1
 O    1.684100      -2.601700      0.3353000    
 O   -3.775400      0.4921000     -0.4335000    
 O   -7.197700      0.6468000      0.2572000    
 O   -5.878700       1.964000     -0.9104000    
 N    4.138100       1.064200      0.3332000    
 N    2.928400      -1.105800     -0.9331000    
 N   0.6708000     -0.7610000     -0.6409000    
 N  -0.5469000      -1.082300     -0.1488000    
 N   -6.051000      0.9334000     -0.1958000    
 C    5.332200      0.2290000      0.3808000    
 C    4.986300      -1.262300      0.4169000    
 C    3.519200       1.155200       1.656800    
 C    4.463500       2.400800     -0.1679000    
 C    4.202000      -1.757800     -0.7965000    
 C    2.236800       1.968600       1.608400    
 C    5.107600       2.330300      -1.542000    
 C    1.752800      -1.582300     -0.3505000    
 C   -2.857600     -0.4302000     -4.1600000E-02
 C   -1.482800     -0.2511000     -0.4780000    
 C   -3.448500      -1.401600      0.7324000    
 C   -4.965500      0.1055000      9.6199997E-02
 C   -4.817400      -1.053700      0.8219000    
 H    5.971300      0.3365000     -0.4992000    
 H    5.964700      0.4853000       1.241000    
 H    4.442200      -1.512000       1.334900    
 H    5.926000      -1.827300      0.4665000    
 H    3.248100      0.1576000       2.018300    
 H    4.201000       1.592100       2.397500    
 H    3.551300       2.992100     -0.2984000    
 H    5.120100       2.949000      0.5193000    
 H    4.765000      -1.568300      -1.716600    
 H    4.044300      -2.838700     -0.7158000    
 H    1.673200       1.818400       2.536100    
 H    1.588700       1.662600      0.7810000    
 H    2.427300       3.043400       1.530400    
 H    5.039500       3.312900      -2.023900    
 H    4.600800       1.615900      -2.199800    
 H    6.174300       2.090500      -1.499100    
 H    2.883900     -0.2455000      -1.470700    
 H   0.7634000      7.4699998E-02  -1.209200    
 H   -1.283300      0.6369000      -1.106100    
 H   -2.960100      -2.256000       1.179300    
 H   -5.594500      -1.586600       1.351500    


%chk=000059056-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000059056

0 1
O 1.414546 -2.872115 -0.388759
O -3.914866 0.630509 -0.160378
O -7.477634 0.291172 -0.417252
O -6.166382 2.149722 -0.044166
N 4.404445 1.187334 0.382697
N 2.907665 -1.093616 -0.040416
N 0.627885 -0.646594 -0.103734
N -0.673668 -0.997993 -0.236419
N -6.326817 0.881380 -0.257285
C 5.551659 0.231305 0.168035
C 5.259023 -1.203283 0.673230
C 4.349335 1.657346 1.806551
C 4.470357 2.342051 -0.572592
C 4.128124 -1.912307 -0.103255
C 2.952697 2.151529 2.225827
C 4.006799 1.985457 -1.996995
C 1.662155 -1.653893 -0.197661
C -2.982778 -0.423621 -0.277499
C -1.598383 -0.054205 -0.136968
C -3.663036 -1.632244 -0.511485
C -5.175982 0.040865 -0.327411
C -5.058076 -1.333250 -0.542328
H 5.753319 0.186997 -0.918078
H 6.475388 0.624597 0.653267
H 5.007581 -1.187309 1.751035
H 6.186458 -1.798735 0.571609
H 4.632969 0.808284 2.453561
H 5.107922 2.457013 1.978253
H 3.818788 3.141136 -0.176027
H 5.504937 2.759971 -0.600157
H 4.435802 -2.070910 -1.159097
H 3.917466 -2.911067 0.319609
H 2.970945 2.498703 3.274772
H 2.212737 1.333266 2.153919
H 2.603046 2.996336 1.605134
H 4.061098 2.878303 -2.645977
H 2.963085 1.623757 -1.994871
H 4.633540 1.202119 -2.458855
H 3.117789 -0.067418 0.083976
H 0.903520 0.334165 0.072407
H -1.385943 1.014370 0.050285
H -3.181884 -2.598625 -0.639811
H -5.888127 -2.016900 -0.699593


