%chk=000237637.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000237637

0 1
S 1.214825 -0.649664 -0.652648
O -3.723994 -2.003682 -0.687321
N -3.155198 0.008792 0.174256
N -0.860718 0.766688 0.235009
N -2.560511 2.105546 1.202702
C 3.498786 0.720973 -0.296084
C 4.185190 -0.271348 0.654162
C 2.009449 0.867916 -0.026143
C 5.691088 -0.328514 0.409819
C -0.496744 -0.434907 -0.347942
C -1.378837 -1.423439 -0.696650
C -2.176485 0.952741 0.505994
C -2.787365 -1.271518 -0.458616
H 3.686784 0.426493 -1.349872
H 3.976801 1.719208 -0.192061
H 3.986129 0.013591 1.706079
H 3.749609 -1.283633 0.531914
H 1.784985 0.996483 1.050376
H 1.583248 1.750974 -0.540570
H 6.173314 -1.041380 1.089014
H 6.166970 0.645770 0.567583
H 5.923451 -0.646501 -0.613213
H -1.068151 -2.360055 -1.159821
H -4.140618 0.148994 0.411152
H -1.845107 2.816395 1.329594
H -3.491200 2.471775 1.069387


%chk=000237637-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000237637

0 1
S 1.210840 -0.831397 -0.516732
O -3.872259 -2.011430 -0.683513
N -3.185365 0.075236 0.119677
N -0.899138 0.749372 0.252445
N -2.579113 2.217150 0.950404
C 3.518705 0.748075 -0.198015
C 4.292621 -0.326347 0.601913
C 2.007267 0.790475 0.080979
C 5.813476 -0.266048 0.345371
C -0.559634 -0.487407 -0.269545
C -1.485048 -1.475946 -0.613420
C -2.205000 0.996214 0.432335
C -2.898695 -1.239840 -0.430888
H 3.695646 0.606391 -1.283013
H 3.927769 1.748244 0.056505
H 4.089324 -0.189006 1.683334
H 3.909499 -1.331697 0.339513
H 1.784969 0.889488 1.155900
H 1.505023 1.606532 -0.460952
H 6.350118 -1.039128 0.924788
H 6.227155 0.719542 0.632174
H 6.042153 -0.427657 -0.724976
H -1.181905 -2.440884 -1.022559
H -4.182207 0.267372 0.259818
H -1.833212 2.872471 1.171333
H -3.547287 2.477921 1.113225


