%chk=000190046.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000190046

0 1
O -2.748469 0.441746 1.000510
O 4.735660 0.803168 0.452617
O 2.857291 0.974018 1.703470
O 0.037150 -2.609320 -2.746079
O -4.645472 0.105859 -0.186652
N -0.681429 -0.761617 -1.838555
N -0.882215 -2.014935 -2.251000
C 0.617245 -0.031751 -1.937451
C 1.345835 -0.006947 -0.587369
C -1.828537 -0.066651 -1.199464
C 2.728260 0.634858 -0.728738
C -2.048027 -0.574319 0.235081
C 3.367307 0.819948 0.620302
C -4.084558 0.671456 0.719799
C 5.546674 1.001587 1.641340
C -4.603855 1.678328 1.682166
H 1.245585 -0.544968 -2.706683
H 0.433352 0.997846 -2.311042
H 0.749811 0.547355 0.169573
H 1.448199 -1.038873 -0.190301
H -1.651355 1.031851 -1.190996
H -2.758669 -0.234634 -1.800595
H 2.661472 1.627864 -1.225591
H 3.387512 0.023262 -1.385072
H -1.111501 -0.681715 0.813813
H -2.627660 -1.514499 0.259677
H 6.553246 0.751205 1.289965
H 5.213732 0.332000 2.441514
H 5.469712 2.047287 1.953273
H -5.397332 1.241753 2.311211
H -5.048027 2.536454 1.152987
H -3.820635 2.063284 2.356288


%chk=000190046-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000190046

0 1
O -3.202810 1.101386 0.706948
O 5.107947 0.603123 0.278530
O 3.339251 0.312692 1.765492
O 0.334967 -2.188340 -2.628949
O -4.466242 -0.862661 0.690865
N -0.686322 -0.431538 -1.669901
N -0.782437 -1.714669 -2.199310
C 0.593474 0.312344 -1.675431
C 1.533861 -0.067263 -0.506361
C -1.953103 0.151207 -1.204492
C 2.894743 0.645546 -0.649416
C -1.996995 0.317389 0.331763
C 3.752906 0.491704 0.597213
C -4.396777 0.371457 0.872787
C 6.047966 0.512717 1.424479
C -5.512729 1.287651 1.319043
H 1.095322 0.076745 -2.634503
H 0.354625 1.391698 -1.653803
H 1.083215 0.202644 0.465366
H 1.683962 -1.161076 -0.505503
H -2.107109 1.139673 -1.677977
H -2.757588 -0.530742 -1.526537
H 2.743330 1.733965 -0.807982
H 3.460300 0.277131 -1.522849
H -1.158343 0.924427 0.707118
H -2.018081 -0.668029 0.828907
H 7.045029 0.630276 0.978209
H 5.946501 -0.466006 1.922305
H 5.839405 1.313200 2.154009
H -5.431050 1.461812 2.407528
H -6.484837 0.816421 1.112289
H -5.442080 2.266018 0.818160


