%chk=000259593.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000259593

0 1
O -1.631258 1.569934 -2.759747
O -2.766921 2.061240 -0.886841
O -4.813800 -3.146696 2.610936
O -3.360741 -3.481478 0.942678
O 2.324203 0.090356 2.874537
O 0.244830 -0.153248 2.352141
O 5.171256 1.258772 -2.457543
O 5.692527 1.054090 -0.366311
N -0.543775 -0.013980 -0.114216
N 1.423457 0.060063 2.058302
N 4.892837 1.054024 -1.286833
C -1.602111 -0.136768 -1.137118
C -2.766282 -0.998876 -0.625012
C -3.427509 -0.474570 0.655419
C -4.596165 -1.356103 1.101765
C 0.767719 0.260264 -0.392530
C -2.095453 1.275502 -1.500368
C 1.749373 0.290208 0.657641
C 1.204018 0.530003 -1.733095
C 3.100196 0.550190 0.348175
C -4.150745 -2.738970 1.479065
C 2.522066 0.782006 -2.013575
C 3.485869 0.787543 -0.965152
H -1.183907 -0.616471 -2.073466
H -2.398994 -2.042630 -0.450927
H -3.522702 -1.096343 -1.431728
H -2.682567 -0.400869 1.477281
H -3.796624 0.565771 0.499603
H -0.845404 -0.169081 0.876787
H -5.125082 -0.878688 1.960667
H -5.364232 -1.435636 0.299912
H 0.466761 0.553824 -2.541985
H 3.850790 0.563716 1.161076
H 2.860368 0.986415 -3.039294
H -1.903506 2.474617 -3.080959
H -4.558193 -4.064431 2.903216


%chk=000259593-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000259593

0 1
O -2.529098 1.081104 -2.816813
O -1.791426 2.187365 -0.905742
O -5.589328 -3.183124 2.037874
O -3.308438 -3.232198 1.615700
O 2.531334 -0.024557 2.895537
O 0.378062 -0.494637 2.333416
O 5.209156 1.699925 -2.499403
O 5.787457 1.406080 -0.307550
N -0.408242 -0.247341 -0.152316
N 1.594344 -0.114271 2.018206
N 4.931461 1.381572 -1.275271
C -1.490727 -0.285830 -1.132422
C -2.717173 -1.056466 -0.559084
C -3.323152 -0.445583 0.727032
C -4.613917 -1.165243 1.169193
C 0.872019 0.158407 -0.413014
C -1.917725 1.133600 -1.556618
C 1.886781 0.219751 0.621460
C 1.284194 0.535223 -1.739087
C 3.208563 0.619384 0.337099
C -4.389224 -2.602089 1.609329
C 2.589499 0.927393 -2.020430
C 3.551664 0.965836 -0.974929
H -1.167344 -0.815611 -2.048855
H -2.398842 -2.094349 -0.355987
H -3.483058 -1.090120 -1.356289
H -2.595993 -0.490837 1.559452
H -3.558633 0.623733 0.569886
H -0.594446 -0.479098 0.837963
H -5.087747 -0.631838 2.014855
H -5.370241 -1.172179 0.359902
H 0.554379 0.514255 -2.552276
H 3.950024 0.657564 1.139200
H 2.894857 1.210443 -3.031213
H -2.849800 1.987506 -3.075882
H -5.418939 -4.120069 2.329578


