%chk=000186572.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000186572

0 1
O 0.053357 -2.469521 -1.257377
O 1.771739 -3.385225 0.555886
C 0.157907 0.479507 0.122001
C 1.616306 0.273249 0.125696
C -0.712310 -0.596873 0.094762
C -0.154629 -2.000080 0.085021
C 1.205389 -2.105289 0.830045
C -0.352750 1.823873 0.139866
C 2.150537 -0.990200 0.441600
C 2.487944 1.333094 -0.197833
C 0.622026 2.966129 0.219241
C 1.915851 2.676429 -0.554162
C -2.130495 -0.385820 0.050434
C -1.708533 2.040948 0.119627
C -2.625554 0.945100 0.070858
C 3.531767 -1.198482 0.428132
C 3.872028 1.115478 -0.211604
C 4.389369 -0.145221 0.098544
C -3.069471 -1.464813 -0.020455
C -4.038648 1.171453 0.037840
C -4.419345 -1.221366 -0.055085
C -4.912337 0.115186 -0.021882
H -0.868770 -2.758159 0.490481
H 1.063209 -2.118219 1.938416
H 0.168326 3.905217 -0.154968
H 0.860069 3.150901 1.290787
H 2.649235 3.485698 -0.366490
H 1.714896 2.698940 -1.648033
H -2.113002 3.052383 0.138049
H 3.925427 -2.187199 0.673756
H 4.549120 1.929493 -0.463315
H 5.466600 -0.307585 0.085825
H -2.690379 -2.488186 -0.058486
H 0.457220 -1.762457 -1.810518
H 1.671529 -3.594380 -0.411890
H -4.403077 2.197375 0.059727
H -5.132921 -2.042278 -0.111306
H -5.988630 0.278502 -0.047289


%chk=000186572-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000186572

0 1
O 0.066113 -2.542571 -1.264286
O 1.781109 -3.443036 0.682047
C 0.169800 0.492537 0.162133
C 1.639599 0.286995 0.143120
C -0.713744 -0.609495 0.123563
C -0.128217 -2.009577 0.123883
C 1.223872 -2.102352 0.869445
C -0.347547 1.840542 0.183410
C 2.181609 -0.995903 0.438131
C 2.510126 1.360511 -0.209091
C 0.643242 2.989627 0.289121
C 1.907865 2.714681 -0.556575
C -2.139199 -0.402677 0.052323
C -1.723938 2.047501 0.144397
C -2.648985 0.955219 0.072297
C 3.572354 -1.212420 0.374817
C 3.903554 1.130713 -0.257312
C 4.435801 -0.147828 0.026635
C -3.083349 -1.479255 -0.057182
C -4.062665 1.180147 0.014685
C -4.456904 -1.229841 -0.116935
C -4.955119 0.109849 -0.073287
H -0.808791 -2.747013 0.576090
H 1.031981 -2.016062 1.956963
H 0.166055 3.937790 -0.018195
H 0.947762 3.109177 1.349990
H 2.654698 3.515573 -0.406128
H 1.633268 2.731631 -1.632301
H -2.120076 3.070786 0.166609
H 3.957788 -2.211251 0.601501
H 4.574343 1.956548 -0.523570
H 5.518109 -0.312544 -0.018573
H -2.724126 -2.510625 -0.120202
H 0.400969 -1.803909 -1.836073
H 1.599633 -3.672555 -0.272124
H -4.433831 2.211706 0.037815
H -5.159572 -2.065709 -0.204664
H -6.034588 0.290689 -0.116579


