%chk=000231179.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000231179

0 1
O 2.305612 -2.369527 -1.082337
O 3.230703 0.186912 -1.764286
O 1.437862 -2.879445 1.373836
O 1.663595 2.321614 -1.180210
O 2.815929 0.750667 1.823950
O 3.771480 2.432445 0.688733
O -2.710923 1.534092 0.929348
N -1.011783 -0.567815 0.471971
N -2.256724 -0.505728 -0.095273
N -5.698188 -1.622991 -0.422026
C 2.251676 -1.299286 -0.127103
C 2.031260 -0.058058 -1.016865
C 1.125984 -1.556459 0.902443
C 1.787671 1.263479 -0.253169
C -0.247195 -1.595288 0.261879
C 2.913530 1.594902 0.730783
C -3.056508 0.633554 0.211706
C -4.405951 0.631151 -0.512663
C -5.120132 -0.623464 -0.459230
H 3.235209 -1.250605 0.402075
H 1.197728 -0.234479 -1.739987
H 1.191375 -0.831384 1.753192
H 0.797013 1.260998 0.282288
H -0.446255 -2.499075 -0.327901
H 2.335184 -3.236635 -0.602354
H 3.481257 -0.629543 -2.265621
H 0.885161 -3.108300 2.150606
H 2.495082 2.393725 -1.730560
H 3.500312 0.940561 2.519654
H -2.621205 -1.268417 -0.680029
H -4.254917 0.959869 -1.572933
H -5.033044 1.447327 -0.056818


%chk=000231179-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000231179

0 1
O 2.241808 -2.470051 -0.923166
O 3.329846 -0.096519 -1.810543
O 1.206267 -2.799844 1.540977
O 1.871831 2.296692 -1.382425
O 3.291203 0.954683 1.716540
O 4.219172 2.424855 0.168244
O -3.299472 1.190968 1.567298
N -1.214803 -0.520943 0.744491
N -2.451458 -0.457420 0.115211
N -4.907157 -1.395780 -2.170793
C 2.198404 -1.309104 -0.011811
C 2.131086 -0.106631 -0.966427
C 1.005463 -1.448024 0.956635
C 2.058903 1.307265 -0.338904
C -0.338386 -1.376511 0.276312
C 3.307587 1.644021 0.490975
C -3.425686 0.428155 0.583812
C -4.747565 0.428353 -0.238309
C -4.854206 -0.570849 -1.308753
H 3.122926 -1.274210 0.595050
H 1.225300 -0.212055 -1.601104
H 1.064446 -0.666655 1.736626
H 1.168904 1.382678 0.307933
H -0.512787 -2.063884 -0.573206
H 2.226046 -3.284253 -0.355317
H 3.435030 -1.011011 -2.182007
H 0.548388 -2.946497 2.265571
H 2.683493 2.285980 -1.955331
H 4.101193 1.192993 2.244305
H -2.662088 -1.050386 -0.703379
H -4.861048 1.444106 -0.660975
H -5.571841 0.294676 0.485568


