%chk=000266978.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000266978

0 1
O 1.736988 -0.621674 -1.120380
O 2.048878 0.479465 0.831970
N -0.688985 2.176770 -0.396346
C -0.841248 1.129328 0.658038
C -0.216140 -0.182836 0.113645
C -1.990254 2.833518 -0.744328
C 0.366676 3.180036 -0.032772
C -0.584865 -1.348013 1.000723
C 1.293821 -0.036904 0.038169
C -2.882184 1.858775 -1.514930
C 0.889041 3.862895 -1.297531
C -1.521550 -2.290555 0.552915
C -0.015378 -1.483908 2.276358
C -1.886585 -3.358638 1.377822
C -0.383175 -2.553481 3.095377
C -1.320103 -3.491756 2.649053
C 3.166442 -0.556345 -1.424572
C 3.502710 0.812003 -1.980972
H -0.353489 1.401412 1.619754
H -1.909013 0.934488 0.897848
H -0.599197 -0.346249 -0.932874
H -2.527487 3.224813 0.146421
H -1.767103 3.712137 -1.392104
H 0.005958 3.939161 0.693428
H 1.210060 2.640090 0.462725
H -2.338335 1.420953 -2.363257
H -3.223485 1.027042 -0.889351
H -3.767853 2.366449 -1.910203
H 1.175231 3.117194 -2.052207
H 0.134697 4.509858 -1.758552
H 1.769263 4.474799 -1.076025
H -1.963712 -2.196165 -0.437389
H 0.722843 -0.756912 2.622610
H -2.613196 -4.089508 1.026630
H 0.062853 -2.656974 4.083492
H -1.605125 -4.324319 3.288946
H 3.734150 -0.795268 -0.507880
H 3.259437 -1.366712 -2.169886
H 3.389028 1.589989 -1.210746
H 2.833979 1.082098 -2.808926
H 4.533407 0.855545 -2.349294


%chk=000266978-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000266978

0 1
O 1.587886 -0.678673 -1.297888
O 2.008616 0.477052 0.683255
N -0.630895 2.265024 -0.262662
C -0.861964 1.135421 0.668364
C -0.303528 -0.215490 0.116627
C -1.859116 2.750431 -0.937722
C 0.218817 3.351891 0.298284
C -0.619684 -1.377246 1.064104
C 1.201646 -0.077180 -0.102904
C -2.497315 1.705785 -1.873204
C 0.922831 4.193092 -0.784559
C -1.568853 -2.360914 0.688973
C -0.014925 -1.462332 2.346017
C -1.912788 -3.407740 1.574104
C -0.355983 -2.509536 3.230019
C -1.307588 -3.484750 2.849544
C 3.043376 -0.616631 -1.641963
C 3.353143 0.668431 -2.415122
H -0.373711 1.334958 1.641362
H -1.943846 0.994126 0.875878
H -0.760367 -0.412530 -0.866812
H -2.623351 3.093459 -0.191933
H -1.585275 3.635708 -1.539092
H -0.368826 4.028072 0.971023
H 0.993870 2.867390 0.917484
H -1.763176 1.367753 -2.625985
H -2.858402 0.820993 -1.317422
H -3.366210 2.144392 -2.398211
H 1.507543 3.534538 -1.451278
H 0.211531 4.766746 -1.406281
H 1.610749 4.918859 -0.312233
H -2.035170 -2.309032 -0.302692
H 0.735647 -0.718809 2.639173
H -2.646923 -4.161937 1.268417
H 0.121695 -2.567101 4.214848
H -1.570755 -4.296751 3.536777
H 3.628282 -0.676267 -0.707375
H 3.205338 -1.518875 -2.253279
H 3.186349 1.554912 -1.780221
H 2.717008 0.749414 -3.313288
H 4.411321 0.665948 -2.736730


