%chk=000212169.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000212169

0 1
I -2.507549 0.715336 -2.803901
I -1.393721 -3.583902 1.490504
O -2.904014 -2.086139 -0.539375
O 2.076407 1.746816 0.608895
N 3.101152 -0.202485 -0.154625
N 4.368750 0.293337 0.051714
C -4.784859 -0.569048 -0.174420
C -6.198735 -0.192805 -0.634956
C -4.186402 -1.638605 -1.077881
C -6.817944 0.865204 0.274283
C -1.790658 -1.315910 -0.502045
C 0.698175 -0.094162 -0.068925
C -1.431153 -0.178849 -1.240816
C -0.862779 -1.849237 0.437476
C -0.196422 0.437442 -0.999659
C 0.361499 -1.250368 0.658740
C 1.993987 0.620332 0.185337
C 5.429313 -0.389246 -0.281072
C 6.746388 0.265984 0.007650
C 5.472231 -1.748550 -0.914709
H -4.138952 0.333377 -0.159890
H -4.802402 -0.931959 0.873710
H -6.844819 -1.092721 -0.653102
H -6.166175 0.184523 -1.676912
H -4.734705 -2.601681 -1.022254
H -4.072026 -1.334722 -2.131443
H -6.897530 0.514243 1.309921
H -6.222337 1.786056 0.287481
H -7.827050 1.133184 -0.059087
H 0.082096 1.348912 -1.545957
H 1.061176 -1.655302 1.397344
H 2.948423 -1.124132 -0.575249
H 7.346820 -0.342563 0.697057
H 6.622760 1.258688 0.474860
H 7.323268 0.414057 -0.915170
H 4.957521 -1.761076 -1.885518
H 5.010491 -2.510795 -0.271931
H 6.501174 -2.084533 -1.104873


%chk=000212169-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000212169

0 1
I -2.631435 0.541014 -4.004906
I -1.519650 -3.485458 0.588991
O -3.045666 -2.011310 -1.803471
O 2.061550 1.953623 -1.177214
N 2.991157 -0.074317 -0.423885
N 4.224997 0.499485 -0.109113
C -4.481333 -0.733617 -0.138642
C -5.903554 -0.174475 0.112141
C -4.388774 -1.401020 -1.516359
C -6.032806 0.495359 1.497267
C -1.881545 -1.289944 -1.573042
C 0.646188 -0.014964 -1.106414
C -1.462395 -0.162657 -2.341390
C -0.975839 -1.766332 -0.579182
C -0.235017 0.479494 -2.097612
C 0.268239 -1.150744 -0.346777
C 1.944987 0.729558 -0.903784
C 5.199348 -0.313461 0.247822
C 6.519492 0.332485 0.595228
C 5.086823 -1.830659 0.332230
H -3.750388 0.096634 -0.071832
H -4.222218 -1.464126 0.650795
H -6.643744 -0.996107 0.028902
H -6.157115 0.559937 -0.679029
H -5.056982 -2.275207 -1.589070
H -4.642188 -0.685756 -2.320655
H -5.811652 -0.223995 2.307717
H -5.327156 1.341121 1.596530
H -7.053804 0.885706 1.659873
H 0.071656 1.360752 -2.668096
H 0.906907 -1.527817 0.457988
H 2.852812 -1.092486 -0.388794
H 6.816732 0.090387 1.634269
H 6.445161 1.425718 0.489204
H 7.326092 -0.039171 -0.066431
H 4.805806 -2.277549 -0.642968
H 4.328424 -2.146826 1.077459
H 6.048288 -2.274574 0.633452


