%chk=000185320.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000185320

0 1
O -2.590876 1.598358 -1.435992
O -3.722738 0.232802 1.656518
C -0.925679 0.461499 -0.098152
C -2.312961 1.064271 -0.132016
C -0.769656 -0.965284 -0.154000
C 0.177924 1.291865 -0.045185
C -3.474042 0.106031 0.249340
C 0.492437 -1.535518 -0.103141
C 1.499478 0.718929 0.020550
C 1.655128 -0.690564 0.002777
C -1.974762 -1.799936 -0.275688
C -3.214121 -1.329106 -0.101145
C 0.011159 2.778086 -0.056743
C 0.689899 -3.018633 -0.148760
C 2.667962 1.541765 0.111186
C 2.977251 -1.237142 0.088334
C 3.921915 0.991615 0.189872
C 4.077930 -0.422658 0.180255
H -2.388295 1.969509 0.523859
H -4.424711 0.485991 -0.201452
H -1.802979 -2.854674 -0.521671
H -4.097765 -1.959915 -0.176314
H -0.348071 3.146866 0.915006
H 0.941893 3.317339 -0.282517
H -0.724930 3.090131 -0.819579
H 1.092668 -3.391756 0.804521
H -0.243221 -3.572121 -0.336017
H 1.389730 -3.306548 -0.946656
H 2.538943 2.627092 0.115643
H 3.104022 -2.319043 0.081537
H -2.371400 0.939954 -2.129233
H -3.005932 -0.196773 2.171738
H 4.807669 1.620499 0.260334
H 5.080631 -0.842230 0.246292


%chk=000185320-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000185320

0 1
O -2.650706 1.504791 -1.607291
O -3.618097 0.222889 1.771809
C -0.948225 0.482043 -0.116442
C -2.355140 1.067309 -0.213344
C -0.793537 -0.964357 -0.179834
C 0.166801 1.328714 -0.031628
C -3.482745 0.138249 0.289435
C 0.490474 -1.553246 -0.122422
C 1.488731 0.743724 0.055493
C 1.647474 -0.696135 0.011634
C -2.014897 -1.782462 -0.326617
C -3.277564 -1.292402 -0.140053
C 0.026924 2.842922 -0.065043
C 0.712297 -3.057936 -0.163122
C 2.659618 1.560446 0.195409
C 2.974091 -1.240317 0.098772
C 3.936245 0.999145 0.284899
C 4.095039 -0.417411 0.231965
H -2.439704 1.996217 0.370880
H -4.436406 0.549967 -0.078795
H -1.901266 -2.840010 -0.582603
H -4.153482 -1.943222 -0.233853
H 0.243403 3.292359 0.923640
H 0.735429 3.286123 -0.787735
H -0.977556 3.157912 -0.378159
H 1.242671 -3.403714 0.744183
H -0.222813 -3.631281 -0.221765
H 1.334210 -3.348198 -1.031212
H 2.552332 2.647855 0.241397
H 3.114650 -2.324242 0.062072
H -2.425007 0.757464 -2.219719
H -2.899657 -0.329023 2.177279
H 4.814795 1.644116 0.395921
H 5.096117 -0.857585 0.298349


