%chk=000106808.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000106808

0 1
O -4.526372 -0.155471 -0.213543
C 1.204197 -1.131921 -0.135514
C 0.350382 0.132852 0.237197
C 2.556769 -1.050864 0.619863
C 3.314507 0.247973 0.329757
C 1.119064 1.410211 -0.047401
C 2.458329 1.481625 0.643711
C 1.445765 -1.211400 -1.651193
C 0.460841 -2.397696 0.330779
C -0.981078 0.101977 -0.460384
C 0.665955 2.416371 -0.797532
C -2.173971 0.008121 0.149855
C -2.380060 -0.075843 1.624222
C -3.416923 -0.016243 -0.683577
H 0.191199 0.102004 1.349271
H 3.185349 -1.918783 0.346482
H 2.379560 -1.142470 1.708264
H 3.627984 0.274052 -0.732641
H 4.248086 0.279344 0.922908
H 3.007036 2.399621 0.354079
H 2.297984 1.567162 1.738291
H 1.835038 -0.264256 -2.043593
H 2.171606 -1.992691 -1.899169
H 0.526810 -1.440564 -2.199408
H 0.289318 -2.398608 1.411591
H -0.519617 -2.489999 -0.150138
H 1.025840 -3.303470 0.087120
H -0.911510 0.160598 -1.551377
H -0.292260 2.426753 -1.290293
H 1.223622 3.323321 -0.972333
H -3.449736 -0.193701 1.873825
H -1.851976 -0.933373 2.061101
H -2.031623 0.833795 2.132024
H -3.273112 0.100575 -1.771443


%chk=000106808-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000106808

0 1
O -4.611364 -0.052524 -0.317157
C 1.227895 -1.154143 -0.146330
C 0.347508 0.121853 0.235982
C 2.592403 -1.040381 0.600379
C 3.359493 0.264401 0.302055
C 1.121016 1.425199 -0.033896
C 2.482864 1.496547 0.642283
C 1.454379 -1.239155 -1.679470
C 0.509133 -2.438560 0.338397
C -1.001127 0.092351 -0.435995
C 0.636935 2.455888 -0.775991
C -2.225658 0.016143 0.178966
C -2.460708 -0.046724 1.674589
C -3.413444 0.001660 -0.711519
H 0.203973 0.057404 1.336510
H 3.213484 -1.919336 0.335285
H 2.403888 -1.103333 1.693367
H 3.653907 0.300032 -0.764240
H 4.294391 0.294651 0.894031
H 2.998217 2.433444 0.362207
H 2.336360 1.522779 1.743987
H 1.805498 -0.280912 -2.101708
H 2.210278 -2.013367 -1.909382
H 0.525135 -1.520274 -2.207799
H 0.352229 -2.419749 1.434198
H -0.477226 -2.559914 -0.144822
H 1.116779 -3.332032 0.100750
H -0.989476 0.138955 -1.537154
H -0.354623 2.433358 -1.240254
H 1.226362 3.368972 -0.923289
H -3.543007 0.018702 1.876980
H -2.091782 -0.997855 2.101897
H -1.951998 0.778764 2.203969
H -3.174710 0.046156 -1.806023


