%chk=000244197.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000244197

0 1
O 4.206584 -2.785908 -0.000175
O -2.028814 -0.397004 -0.000054
O -0.625941 -2.204778 -0.000264
N 0.169596 0.021604 -0.000021
N 1.835030 2.247235 0.000319
C 2.424758 0.988407 0.000185
C 3.839276 0.812485 0.000210
C 1.572921 -0.188181 0.000016
C 4.400545 -0.484509 0.000075
C 2.135668 -1.451165 -0.000109
C 3.549185 -1.582267 -0.000077
C 4.650624 2.000700 0.000377
C -4.364585 -0.409925 -0.000129
C 4.056233 3.232308 0.000507
C -3.175767 -1.324336 -0.000232
C 2.620453 3.315095 0.000473
C -0.787034 -1.002077 -0.000104
C -4.920404 0.018911 1.214410
C -4.920654 0.018866 -1.214569
C -6.036257 0.860282 1.211388
C -6.036509 0.860235 -1.211347
C -6.596127 1.279510 0.000070
C 3.416633 -4.002613 -0.000428
H 5.477590 -0.625724 0.000093
H 1.498817 -2.341452 -0.000225
H 5.734979 1.889246 0.000397
H -0.166864 1.001828 0.000077
H -3.096690 -1.958538 0.901295
H -3.096628 -1.958270 -0.901941
H 4.638072 4.151567 0.000634
H 2.132437 4.296860 0.000578
H -4.479693 -0.297099 2.159147
H -4.480142 -0.297178 -2.159387
H -6.467829 1.192188 2.154496
H -6.468278 1.192103 -2.154378
H -7.465750 1.934877 0.000148
H 4.197996 -4.773445 -0.000570
H 2.805994 -4.058946 -0.906743
H 2.805978 -4.059290 0.905855


%chk=000244197-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000244197

0 1
O 4.346570 -2.854588 -0.000400
O -1.985341 -0.305703 0.000223
O -0.621240 -2.228808 -0.000056
N 0.259627 -0.031148 0.000340
N 1.796679 2.147188 0.000471
C 2.456855 0.930897 0.000257
C 3.895489 0.805095 0.000115
C 1.645205 -0.263692 0.000176
C 4.493432 -0.486459 -0.000107
C 2.246448 -1.529981 -0.000043
C 3.674402 -1.626036 -0.000183
C 4.643867 2.031589 0.000208
C -4.411728 -0.339680 -0.000105
C 3.971573 3.255466 0.000424
C -3.181442 -1.212498 -0.000113
C 2.539183 3.270103 0.000550
C -0.747939 -0.974215 0.000313
C -4.998132 0.077026 1.221367
C -4.998116 0.077078 -1.221565
C -6.146990 0.898662 1.223635
C -6.146978 0.898711 -1.223813
C -6.723918 1.311396 -0.000085
C 3.543671 -4.083793 -0.000523
H 5.580823 -0.606828 -0.000220
H 1.605859 -2.413526 -0.000096
H 5.739037 1.991141 0.000107
H 0.012188 0.970757 0.000483
H -3.120519 -1.856179 0.895443
H -3.120296 -1.855837 -0.895899
H 4.518852 4.203135 0.000499
H 1.992466 4.219756 0.000720
H -4.550578 -0.240928 2.170827
H -4.550549 -0.240833 -2.171034
H -6.592014 1.214303 2.173711
H -6.591991 1.214390 -2.173882
H -7.616535 1.947098 -0.000076
H 4.279384 -4.901195 -0.000719
H 2.908968 -4.149985 -0.904333
H 2.909132 -4.150273 0.903381


