%chk=000133286.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000133286

0 1
 O    1.412600      -1.868400      0.2905000    
 O    3.993900      -2.877000      6.4599998E-02
 O   -4.614200     -0.5742000      -1.674500    
 N    3.444000      0.4985000      -1.354500    
 N   -3.711200      0.2604000      0.3146000    
 N    1.328600      1.9099999E-02   3.341800    
 C    3.864000       1.820200     -0.9091000    
 C    3.936600     -0.5352000     -0.4542000    
 C    3.500900      -1.935300     -0.8927000    
 C    1.985300      -2.093100     -0.9940000    
 C    5.396200       1.887900     -0.8976000    
 C    3.300800       2.862700      -1.882400    
 C    3.339300       2.072300      0.4482000    
 C   0.1520000      -1.334400      0.3172000    
 C  -0.2623000     -0.5239000       1.370300    
 C  -0.7130000      -1.617100     -0.7365000    
 C   -2.421700     -0.2723000      0.3163000    
 C   -1.551700      8.2999999E-03   1.370000    
 C   -2.002300      -1.085000     -0.7369000    
 C    2.913200       2.279200       1.551900    
 C   0.6164000     -0.2240000       2.459200    
 C   -4.718100      9.3099996E-02 -0.6481000    
 C   -6.007200      0.8138000     -0.3399000    
 C   -6.174900       1.635300      0.9032000    
 C   -7.007200      0.6893000      -1.227400    
 H    3.603700     -0.3938000      0.5804000    
 H    5.031500     -0.5596000     -0.4204000    
 H    3.949600      -2.183800      -1.862100    
 H    3.781500      0.3184000      -2.299800    
 H    1.749200      -3.121900      -1.291300    
 H    1.610300      -1.400000      -1.756800    
 H    5.729300       2.926300     -0.7699000    
 H    5.854400       1.331400     -7.2300002E-02
 H    5.827300       1.532700      -1.841300    
 H    3.680900       2.709200      -2.899400    
 H    2.205100       2.822600      -1.925300    
 H    3.573500       3.880300      -1.577100    
 H    4.963400      -2.803100      7.6600000E-02
 H  -0.4431000      -2.273200      -1.558600    
 H   -1.880400      0.6432000       2.190800    
 H   -2.615000      -1.357400      -1.584100    
 H    2.546800       2.490200       2.528900    
 H   -3.920100      0.8385000       1.123600    
 H   -6.042600       1.015800       1.796200    
 H   -5.448700       2.454400      0.9254000    
 H   -7.172000       2.085000      0.9662000    
 H   -7.960800       1.182300      -1.064400    
 H   -6.920900      0.1033000      -2.136000    


%chk=000133286-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000133286

0 1
O 1.323422 -0.967951 0.002380
O 3.425783 -3.030648 -0.011097
O -5.114461 -0.671905 -1.615051
N 4.258873 0.369667 -1.424733
N -4.209614 0.172453 0.376528
N 1.023091 0.781837 3.090617
C 4.708827 1.739375 -0.999258
C 4.175600 -0.679556 -0.392448
C 3.380101 -1.888521 -0.934742
C 1.906027 -1.595010 -1.199144
C 6.202079 1.755852 -0.532410
C 4.529756 2.675905 -2.224831
C 3.853307 2.203761 0.121888
C -0.038953 -0.709627 0.000178
C -0.556317 -0.036509 1.151499
C -0.933227 -1.064467 -1.039576
C -2.831572 -0.134677 0.205132
C -1.942534 0.238005 1.241589
C -2.310105 -0.786464 -0.945712
C 3.175214 2.571981 1.082515
C 0.318575 0.387884 2.207734
C -5.271577 -0.092345 -0.494334
C -6.626103 0.366543 0.004967
C -6.758433 1.058375 1.352941
C -7.695158 0.129137 -0.801993
H 3.650768 -0.267966 0.485516
H 5.174557 -1.055834 -0.048110
H 3.819181 -2.193525 -1.914805
H 4.803468 0.068481 -2.246714
H 1.387939 -2.549508 -1.413698
H 1.814551 -0.896447 -2.052499
H 6.503949 2.769321 -0.214524
H 6.355836 1.072924 0.321209
H 6.858526 1.440132 -1.365707
H 5.153612 2.322302 -3.068670
H 3.474850 2.683265 -2.543498
H 4.837222 3.705805 -1.976157
H 4.296628 -3.035606 0.461219
H -0.564346 -1.564764 -1.938256
H -2.313739 0.752700 2.135760
H -2.994132 -1.066582 -1.748571
H 2.568839 2.834902 1.931033
H -4.444240 0.643184 1.252660
H -6.427468 0.408479 2.187601
H -6.175699 2.000301 1.395866
H -7.810716 1.321900 1.548550
H -8.709650 0.427989 -0.517512
H -7.549636 -0.373551 -1.764033


