%chk=000198390.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000198390

0 1
O -2.626733 0.953954 -0.034465
O -1.961261 -0.973437 -1.121971
O -1.962463 -0.890445 1.189197
C -0.253779 0.370524 -0.012266
C 1.174875 0.916336 -0.031096
C -1.289302 1.524186 -0.054418
C -0.574685 -0.541633 -1.220001
C -0.576088 -0.452344 1.257631
C -2.632287 -0.462734 0.016418
C 2.254812 -0.172555 0.008228
C 3.662535 0.441346 -0.011921
C 4.743941 -0.635239 0.027346
H 1.315556 1.605132 0.827649
H 1.316381 1.542178 -0.936613
H -1.243393 2.183033 0.827947
H -1.242505 2.117688 -0.981953
H -0.499689 -0.023452 -2.189526
H 0.015034 -1.472854 -1.233124
H 0.013749 -1.380061 1.338572
H -0.502386 0.134348 2.187407
H -3.666904 -0.826631 0.028949
H 2.136584 -0.799125 0.913572
H 2.138357 -0.861041 -0.851217
H 3.788639 1.127954 0.848370
H 3.790573 1.065466 -0.918297
H 4.675571 -1.311602 -0.832589
H 4.673676 -1.249117 0.932801
H 5.745795 -0.190172 0.012671


%chk=000198390-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000198390

0 1
O -2.681720 0.991844 -0.211084
O -1.990256 -1.141129 -1.046744
O -2.045688 -0.739436 1.312108
C -0.288309 0.354000 -0.047291
C 1.163725 0.887536 -0.096298
C -1.306183 1.526290 0.015535
C -0.668577 -0.488251 -1.295027
C -0.568926 -0.537390 1.193026
C -2.675375 -0.444012 0.032989
C 2.276399 -0.175156 0.075300
C 3.691588 0.432429 -0.060007
C 4.811236 -0.615168 0.118170
H 1.281826 1.656607 0.695959
H 1.312778 1.415050 -1.061870
H -1.273952 2.028366 1.002412
H -1.124334 2.267332 -0.783454
H -0.747593 0.149867 -2.197003
H 0.046168 -1.307835 -1.481019
H -0.085637 -1.528069 1.102915
H -0.245969 -0.049795 2.130438
H -3.711606 -0.793781 0.067437
H 2.187610 -0.659204 1.068781
H 2.157401 -0.980550 -0.677342
H 3.814935 1.240076 0.690166
H 3.788060 0.914246 -1.054385
H 4.729517 -1.416304 -0.640322
H 4.755444 -1.090711 1.115447
H 5.812040 -0.157145 0.018465


