%chk=000298036.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000298036

0 1
O -0.878799 -3.346623 -0.082496
O -2.233048 -1.996236 1.114138
O -3.626962 2.061806 0.213137
O -1.768280 3.048860 -0.589285
N 0.682973 1.146622 0.210539
C 1.950762 0.705941 -0.209123
C 2.175046 -0.683433 -0.404395
C -0.457626 0.295398 0.198194
C -0.144389 -1.145613 0.173884
C 1.102369 -1.599861 -0.140638
C 3.020409 1.620064 -0.439666
C 0.542202 2.538090 0.707600
C 3.451884 -1.132030 -0.830541
C -1.745236 0.740749 0.189714
C 4.250034 1.149822 -0.853714
C 4.475259 -0.233643 -1.051701
C -1.213169 -2.122567 0.479838
C -2.275194 2.051100 -0.105667
C -1.814060 -4.434025 0.147883
C -4.347401 3.284449 -0.083401
H 1.309535 -2.677064 -0.194725
H 2.862174 2.690489 -0.312668
H -0.249053 2.595730 1.478297
H 0.246013 3.226539 -0.116976
H 1.474767 2.897349 1.169967
H 3.609398 -2.201452 -0.981921
H -2.550876 0.006960 0.393249
H 5.067014 1.850509 -1.039427
H 5.455234 -0.573870 -1.380397
H -1.407400 -5.234508 -0.478328
H -2.818892 -4.135152 -0.170452
H -1.808147 -4.696200 1.210193
H -3.976475 4.089186 0.557706
H -5.381586 3.014729 0.153182
H -4.222282 3.545287 -1.139300


%chk=000298036-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000298036

0 1
O -0.781394 -3.493425 0.027560
O -2.364502 -2.039758 0.901833
O -3.647762 2.185023 0.206971
O -1.648527 3.021978 -0.667612
N 0.651673 1.124255 0.277434
C 1.905419 0.733859 -0.225098
C 2.145753 -0.655294 -0.499913
C -0.487054 0.267533 0.239851
C -0.180702 -1.176381 0.140919
C 1.089334 -1.591949 -0.230577
C 2.953792 1.672707 -0.436515
C 0.553294 2.432399 0.963174
C 3.421342 -1.068993 -0.977736
C -1.792857 0.754871 0.299606
C 4.203811 1.236720 -0.913347
C 4.448853 -0.136038 -1.185940
C -1.225246 -2.212176 0.401782
C -2.263485 2.077574 -0.085717
C -1.742747 -4.588748 0.286106
C -4.285889 3.434721 -0.249140
H 1.282891 -2.662569 -0.336979
H 2.783923 2.738825 -0.268969
H -0.281434 2.379375 1.680261
H 0.335372 3.253108 0.260443
H 1.490140 2.615776 1.516600
H 3.585784 -2.134157 -1.178332
H -2.579290 0.034762 0.526096
H 4.994978 1.974419 -1.087160
H 5.426652 -0.457535 -1.557440
H -1.239739 -5.494385 -0.081196
H -2.684842 -4.407491 -0.257930
H -1.959794 -4.663215 1.365154
H -3.815020 4.311508 0.229101
H -5.338788 3.339332 0.053979
H -4.197739 3.540773 -1.344567


