%chk=000248336.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000248336

0 1
S -1.029875 -1.956271 0.084964
O 1.327236 2.369995 0.924953
N 1.568937 -1.516539 -0.259667
N 0.285827 0.363593 0.515307
C 2.777335 -0.776410 -0.210106
C 2.732995 0.576209 0.197147
C 0.376682 -0.873392 0.123714
C 4.001473 -1.384514 -0.567679
C 3.931047 1.312896 0.241429
C -2.413024 -0.929219 -0.240287
C 1.443642 1.219172 0.576067
C -4.726394 0.536917 -0.749176
C 5.166497 -0.629040 -0.513297
C 5.137104 0.718366 -0.110044
C -3.189218 -1.242423 -1.360906
C -2.763071 0.114609 0.620994
C -4.353301 -0.513475 -1.607101
C -3.922872 0.847324 0.361197
C -5.961305 1.331562 -1.016618
H 1.580564 -2.487003 -0.570713
H 4.032920 -2.424875 -0.879766
H 3.887788 2.360765 0.558194
H 6.119714 -1.085642 -0.786916
H 6.061817 1.291341 -0.074814
H -2.897406 -2.045041 -2.039662
H -2.128674 0.373729 1.475677
H -4.968118 -0.754378 -2.471818
H -4.197805 1.669521 1.020496
H -6.597029 1.407196 -0.122440
H -6.580951 0.905977 -1.816540
H -5.707733 2.359952 -1.318190


%chk=000248336-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000248336

0 1
S -0.995585 -2.061771 0.046513
O 1.360159 2.420317 0.894370
N 1.618106 -1.488241 -0.305278
N 0.316609 0.356933 0.490286
C 2.831970 -0.778322 -0.222762
C 2.778077 0.579571 0.210098
C 0.429187 -0.881375 0.079734
C 4.066756 -1.382996 -0.569728
C 3.984481 1.318023 0.298933
C -2.451527 -0.966354 -0.263425
C 1.464044 1.210402 0.551265
C -4.800531 0.550327 -0.750190
C 5.249458 -0.627144 -0.476022
C 5.213603 0.724650 -0.039866
C -3.291989 -1.306569 -1.345718
C -2.764273 0.120634 0.582636
C -4.465406 -0.552379 -1.575953
C -3.929637 0.872955 0.324305
C -6.047566 1.376903 -1.010086
H 1.604731 -2.438518 -0.683270
H 4.097675 -2.427051 -0.902717
H 3.916776 2.358433 0.633357
H 6.206193 -1.089564 -0.741797
H 6.142092 1.300316 0.028397
H -3.034907 -2.144189 -2.002393
H -2.095245 0.389142 1.402760
H -5.119255 -0.821313 -2.413908
H -4.165304 1.724228 0.974084
H -6.656780 1.485705 -0.093908
H -6.682744 0.920513 -1.788321
H -5.784367 2.397634 -1.346994


