%chk=000254077.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000254077

0 1
O -5.027462 -0.842165 0.228852
O 5.678541 -0.034550 -1.014759
C -2.548130 -0.608928 0.090422
C -1.752842 0.714799 -0.143107
C -0.375014 0.664325 0.531833
C 0.434056 -0.503247 -0.100862
C -3.954295 -0.214134 -0.499436
C -1.773299 -1.733569 -0.615498
C -2.737775 1.819949 0.278268
C -0.347804 -1.834830 -0.044460
C 0.381674 2.010570 0.421511
C 1.845342 -0.637221 0.565709
C -4.117813 1.295427 -0.168596
C -2.733114 -0.952515 1.576561
C 1.760453 1.872003 1.104656
C 2.535362 0.726211 0.521414
C -4.142497 -0.529427 -1.980982
C 0.549397 2.510118 -1.016220
C 1.771632 -1.084406 2.038968
C 2.637940 -1.698887 -0.177660
C 3.759285 0.904692 -0.000107
C 3.851577 -1.503384 -0.696864
C 4.544921 -0.189160 -0.606066
H -1.583358 0.823158 -1.246053
H -0.517461 0.445832 1.620685
H 0.608054 -0.253443 -1.178231
H -1.722639 -1.549148 -1.705031
H -2.292040 -2.701309 -0.494095
H -2.498428 2.786189 -0.191896
H -2.712611 1.987413 1.368218
H -0.400662 -2.195396 1.001759
H 0.206816 -2.612496 -0.605385
H -0.205029 2.777598 0.987340
H -4.874712 1.409798 0.631012
H -4.503611 1.856657 -1.033022
H -1.789705 -0.888467 2.129268
H -3.447320 -0.270653 2.057860
H -3.132074 -1.963091 1.706345
H 1.632407 1.719814 2.196174
H 2.320486 2.824635 1.010569
H -4.034563 -1.596952 -2.195648
H -5.151369 -0.240819 -2.306377
H -3.427102 0.013437 -2.607558
H 1.136652 1.811577 -1.624917
H -0.417071 2.648927 -1.512514
H 1.071231 3.473525 -1.043819
H 2.767237 -1.087982 2.500356
H 1.131221 -0.419605 2.630057
H 1.363315 -2.097084 2.134956
H 2.143636 -2.671453 -0.246490
H -5.011561 -1.808368 0.118120
H 4.253075 1.876935 -0.017398
H 4.411053 -2.283896 -1.213063


%chk=000254077-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000254077

0 1
O -5.127921 -0.968720 0.013965
O 5.625981 0.031971 -1.384576
C -2.592506 -0.624668 0.127285
C -1.776708 0.691318 -0.081270
C -0.374121 0.660312 0.565932
C 0.431747 -0.548627 -0.021726
C -3.970839 -0.224283 -0.543851
C -1.795039 -1.780318 -0.522745
C -2.766749 1.809481 0.335082
C -0.366997 -1.882162 0.079241
C 0.387771 2.014115 0.414684
C 1.900274 -0.652992 0.604234
C -4.165757 1.266073 -0.105651
C -2.853275 -0.934935 1.627681
C 1.787504 1.882568 1.091737
C 2.559966 0.724369 0.497738
C -4.000716 -0.385182 -2.079145
C 0.523943 2.518861 -1.042245
C 1.849147 -1.077592 2.116212
C 2.696507 -1.726051 -0.116209
C 3.756267 0.917168 -0.141598
C 3.886612 -1.515132 -0.746342
C 4.509118 -0.170083 -0.799489
H -1.612031 0.785645 -1.177094
H -0.503036 0.498259 1.657184
H 0.582432 -0.344728 -1.104120
H -1.705133 -1.609951 -1.613908
H -2.312975 -2.752589 -0.387163
H -2.530533 2.778934 -0.138720
H -2.730705 1.969216 1.429691
H -0.437953 -2.201357 1.135532
H 0.177914 -2.681802 -0.456551
H -0.183156 2.776945 0.982925
H -4.899160 1.290401 0.718290
H -4.590944 1.858617 -0.935027
H -1.915816 -1.017807 2.203366
H -3.478894 -0.161576 2.103585
H -3.399272 -1.889093 1.730165
H 1.635980 1.727269 2.179582
H 2.357565 2.822377 0.973090
H -3.886998 -1.443449 -2.384394
H -4.972566 -0.023668 -2.459403
H -3.202696 0.195053 -2.576392
H 1.090085 1.813605 -1.676695
H -0.462763 2.686194 -1.509252
H 1.067250 3.482018 -1.060638
H 2.860164 -1.024530 2.556401
H 1.181531 -0.424163 2.703983
H 1.489699 -2.115993 2.221769
H 2.282419 -2.742257 -0.072804
H -5.103070 -1.897947 -0.331917
H 4.205173 1.916618 -0.202400
H 4.437285 -2.328729 -1.233232


