%chk=000163670.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000163670

0 1
 O    5.691200      0.7387000      -1.085600    
 O   -5.691000      0.7406000       1.083900    
 N   0.1628000      0.7388000     -0.6052000    
 N  -0.1625000      0.7399000      0.6054000    
 C    4.335100      0.7386000     -0.9687000    
 C   -4.334900      0.7403000      0.9675000    
 C    1.556000      0.7388000     -0.7263000    
 C   -1.562500      0.7401000      0.7266000    
 C    3.640300     -0.4693000     -0.9067000    
 C   -3.640100     -0.4677000      0.9079000    
 C    3.640300       1.946600     -0.9095000    
 C   -3.640100       1.948200      0.9063000    
 C    2.250700     -0.4692000     -0.7856000    
 C   -2.250400     -0.4679000      0.7872000    
 C    2.250800       1.946800     -0.7882000    
 C   -2.250500       1.948100      0.7855000    
 C    6.407100     -0.1267000     -0.2756000    
 C   -6.406700     -0.1263000      0.2752000    
 C    6.077900     -0.2231000       1.064300    
 C   -6.076900     -0.2252000      -1.064400    
 C    7.433600     -0.8717000     -0.8272000    
 C   -7.433300     -0.8704000      0.8278000    
 C    6.799700      -1.094100       1.880500    
 C   -6.798400      -1.097700      -1.879200    
 C    8.155400      -1.742800     -1.1200000E-02
 C   -8.154800      -1.743000      1.3100000E-02
 C    7.838400      -1.854000       1.342700    
 C   -7.837300      -1.856600      -1.340400    
 H    4.152800      -1.425300     -0.9742000    
 H   -4.152600      -1.423600      0.9768000    
 H    4.176200       2.890700     -0.9568000    
 H   -4.176100       2.892400      0.9517000    
 H    1.717500      -1.415500     -0.7438000    
 H   -1.716100      -1.413300      0.7473000    
 H    1.718300       2.893300     -0.7434000    
 H   -1.717000       2.893700      0.7391000    
 H    5.289800      0.3751000       1.512100    
 H   -5.288700      0.3723000      -1.513100    
 H    7.681400     -0.7863000      -1.880900    
 H   -7.681400     -0.7830000       1.881200    
 H    6.556700      -1.176700       2.935900    
 H   -6.555000      -1.182300      -2.934300    
 H    8.964300      -2.334300     -0.4298000    
 H   -8.963900      -2.333800      0.4326000    
 H    8.401300      -2.531100       1.978400    
 H   -8.400000      -2.535000      -1.975000    


%chk=000163670-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000163670

0 1
O 5.872055 -0.709486 -1.225497
O -5.871702 -0.703940 1.228082
N 0.255561 -0.661637 -0.603438
N -0.255219 -0.658454 0.606010
C 4.485585 -0.643718 -0.971045
C -4.485249 -0.639312 0.973362
C 1.682345 -0.662150 -0.645381
C -1.681986 -0.659107 0.647889
C 3.931548 -0.664688 0.337434
C -3.931155 -0.665631 -0.334996
C 3.652137 -0.647130 -2.113449
C -3.651830 -0.638012 2.115804
C 2.537214 -0.673799 0.495849
C -2.536810 -0.675452 -0.493313
C 2.256520 -0.655952 -1.945960
C -2.256215 -0.647443 1.948410
C 6.819741 -0.184973 -0.304728
C -6.819419 -0.183593 0.304966
C 6.622129 1.041828 0.370632
C -6.621931 1.040299 -0.375683
C 8.029080 -0.902100 -0.183036
C -8.028643 -0.901424 0.186352
C 7.655643 1.541817 1.193546
C -7.655481 1.536572 -1.200797
C 9.054612 -0.386829 0.640060
C -9.054223 -0.389857 -0.638993
C 8.871567 0.832390 1.334399
C -8.871308 0.826369 -1.338591
H 4.589586 -0.689324 1.211522
H -4.589136 -0.693719 -1.209021
H 4.112378 -0.642501 -3.105384
H -4.112105 -0.629313 3.107696
H 2.081881 -0.697226 1.490427
H -2.081458 -0.703033 -1.487778
H 1.582976 -0.653514 -2.808854
H -1.582693 -0.641299 2.811305
H 5.689024 1.600018 0.245290
H -5.688904 1.599137 -0.252687
H 8.148592 -1.841000 -0.731709
H -8.148029 -1.837957 0.739081
H 7.510755 2.492974 1.717493
H -7.510721 2.485464 -1.728868
H 9.995077 -0.939676 0.739036
H -9.994613 -0.943246 -0.735619
H 9.668483 1.227809 1.972838
H -9.668261 1.218917 -1.978755


