%chk=000249256.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000249256

0 1
O 1.286048 -0.247782 2.086872
O 0.772085 2.907646 -1.063213
O -5.530990 -0.895170 0.718781
N 0.593133 0.865629 0.085855
C 1.545439 -0.146522 0.693049
C 2.909148 0.500589 0.440087
C 2.744132 1.725326 -0.246043
C 1.418338 -1.538753 0.111882
C 1.293744 1.978648 -0.498393
C -0.824800 0.671580 0.066074
C 4.165064 0.043915 0.791519
C 3.832391 2.508750 -0.591141
C 1.364323 -1.711709 -1.278440
C 1.384627 -2.652136 0.962513
C 5.276855 0.838835 0.443219
C -1.637955 1.451298 -0.781035
C -1.412582 -0.299579 0.902667
C 5.114764 2.046590 -0.234640
C -3.016698 1.253634 -0.790234
C -2.790208 -0.487016 0.873842
C 1.275519 -2.999474 -1.813287
C 1.295633 -3.937200 0.420815
C -3.611090 0.285526 0.031363
C 1.241012 -4.111933 -0.965669
C -5.080097 0.022261 0.062740
C -5.970659 0.944937 -0.747937
C -7.446245 0.608103 -0.574614
H 4.295942 -0.900382 1.319262
H 3.699778 3.452526 -1.122036
H 1.307227 0.633560 2.526991
H 1.385477 -0.847042 -1.941979
H 1.420679 -2.509379 2.045573
H 6.277985 0.496695 0.710280
H -1.198137 2.218009 -1.425916
H -0.798094 -0.902313 1.575868
H 5.988122 2.645184 -0.495687
H -3.626456 1.867430 -1.454982
H -3.255458 -1.244719 1.514889
H 1.229113 -3.135424 -2.892955
H 1.264664 -4.802616 1.081358
H 1.168486 -5.114310 -1.385999
H -5.784681 1.996987 -0.447949
H -5.690602 0.876896 -1.819615
H -7.757404 0.708795 0.473972
H -8.081675 1.258675 -1.183234
H -7.651596 -0.434067 -0.856472


%chk=000249256-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000249256

0 1
O 1.274823 -0.226393 2.168953
O 0.821440 2.927617 -1.154622
O -5.633894 -0.871776 0.749537
N 0.593115 0.861157 0.062696
C 1.523373 -0.128439 0.727098
C 2.895387 0.493192 0.455269
C 2.751470 1.691946 -0.265435
C 1.409687 -1.546860 0.152944
C 1.309315 1.946832 -0.529835
C -0.826777 0.691306 0.057191
C 4.162727 0.026396 0.840311
C 3.862256 2.473152 -0.634880
C 1.172706 -1.733820 -1.229959
C 1.628380 -2.670780 0.984829
C 5.290618 0.805136 0.478966
C -1.664754 1.547506 -0.714551
C -1.427898 -0.350363 0.823722
C 5.143922 2.014228 -0.251956
C -3.057826 1.353247 -0.718217
C -2.818045 -0.529628 0.805059
C 1.144227 -3.034917 -1.774836
C 1.596929 -3.972823 0.436601
C -3.664134 0.313648 0.035283
C 1.357095 -4.159541 -0.943793
C -5.144734 0.072553 0.058897
C -6.053174 0.992599 -0.767722
C -7.543476 0.627979 -0.661409
H 4.277828 -0.911413 1.392884
H 3.721821 3.400745 -1.198649
H 1.479187 0.650232 2.585278
H 0.995681 -0.867932 -1.877659
H 1.798389 -2.517632 2.054306
H 6.293125 0.467309 0.763514
H -1.220205 2.357224 -1.294022
H -0.810714 -1.001990 1.443041
H 6.034129 2.592695 -0.521153
H -3.671440 2.028165 -1.324048
H -3.284210 -1.327251 1.392924
H 0.950501 -3.171699 -2.844278
H 1.756108 -4.839385 1.087907
H 1.330743 -5.169641 -1.367258
H -5.884942 2.038333 -0.437181
H -5.718978 0.957211 -1.824965
H -7.886878 0.677821 0.385878
H -8.156546 1.318075 -1.268621
H -7.722052 -0.403526 -1.010040


