%chk=000189730.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000189730

0 1
O 1.996393 -1.446804 -0.092944
O 0.504974 0.067047 -1.003423
O 4.741283 1.093012 -1.754866
O 2.756840 -0.425342 -3.275486
O 5.106564 -0.441441 0.889751
O 0.957119 -0.335205 2.450471
O 1.664755 1.528585 1.420668
O -2.801054 2.416577 1.699859
O -5.159480 -2.625845 -0.526534
O -5.527933 -0.748936 0.482217
N -1.051850 1.688815 0.395431
N -4.807080 -1.532971 -0.107946
C 4.017884 -0.033417 -1.245072
C 2.648176 0.090133 -1.945416
C 3.924244 0.075044 0.293579
C 2.693953 -0.658538 0.875592
C 1.591609 -0.832706 -1.306353
C 1.739869 0.328032 1.559823
C -0.770769 -0.432365 -0.791029
C -1.614607 0.468646 -0.066279
C -1.230222 -1.656029 -1.271060
C -2.944268 0.093749 0.148176
C -2.560837 -2.018164 -1.043290
C -3.397712 -1.143087 -0.342012
C -1.679351 2.604786 1.276326
C -0.814115 3.779386 1.617976
H 4.537895 -0.969185 -1.556767
H 2.310707 1.156671 -1.976916
H 3.949103 1.155577 0.607907
H 3.001847 -1.450368 1.614826
H 1.281611 -1.695801 -1.938994
H 5.645300 1.126556 -1.361060
H 3.337603 0.169479 -3.813512
H 5.238937 -1.393742 0.677322
H -0.569378 -2.328671 -1.817744
H 0.280905 0.252201 2.900341
H -3.635472 0.755163 0.704635
H -2.949375 -2.975621 -1.409086
H -0.087114 1.879651 0.082293
H 0.228327 3.501273 1.847915
H -1.217780 4.305440 2.498913
H -0.784101 4.513115 0.798470


%chk=000189730-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000189730

0 1
O 2.013071 -1.501985 -0.234845
O 0.460060 0.188300 -0.938917
O 5.038898 0.809646 -1.783216
O 2.699995 0.286961 -3.263634
O 5.270887 -0.753113 0.819657
O 0.851112 -0.427416 2.271748
O 1.931528 1.483268 1.503871
O -3.021628 2.636412 1.541616
O -5.131020 -2.867510 -0.406688
O -5.607384 -0.885681 0.616850
N -1.187645 1.731031 0.392023
N -4.800813 -1.686518 0.006085
C 4.058191 -0.130587 -1.242499
C 2.702655 0.324491 -1.806349
C 4.049391 -0.121457 0.298271
C 2.750161 -0.779537 0.841054
C 1.597649 -0.643078 -1.340262
C 1.826553 0.235546 1.547442
C -0.811043 -0.385816 -0.719968
C -1.712633 0.485850 -0.027728
C -1.205111 -1.669917 -1.137084
C -3.036952 0.055012 0.207204
C -2.523528 -2.103137 -0.901037
C -3.411987 -1.230540 -0.239674
C -1.829159 2.734589 1.133605
C -0.956181 3.958647 1.390005
H 4.273421 -1.161546 -1.601798
H 2.495383 1.348009 -1.431553
H 4.119625 0.920661 0.651154
H 2.992401 -1.575196 1.564489
H 1.326225 -1.332797 -2.155146
H 5.918248 0.636186 -1.360706
H 3.483578 0.811016 -3.574671
H 5.297720 -1.704206 0.535003
H -0.497516 -2.342868 -1.626769
H 0.214048 0.218284 2.684588
H -3.745633 0.699338 0.729903
H -2.867364 -3.092090 -1.211459
H -0.216688 1.903310 0.111312
H 0.110976 3.698854 1.507443
H -1.314198 4.464723 2.299152
H -1.051891 4.669563 0.548230


