%chk=000239462.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000239462

0 1
S 0.029929 0.462006 -0.541656
O 5.094045 0.857658 -1.189274
N 4.298636 -0.465906 0.474333
N 1.957827 -0.732803 0.877804
C -2.336413 -0.205440 0.356602
C -0.912055 -0.504746 0.684368
C -3.031731 -1.005089 -0.565101
C -2.989309 0.876814 0.968846
C 1.710527 0.134713 -0.188746
C -4.366927 -0.724856 -0.866100
C -4.324665 1.151255 0.663192
C -5.015712 0.351851 -0.253026
C 2.697233 0.712963 -0.935624
C 4.089666 0.447355 -0.650014
C 3.223853 -1.006059 1.176607
H -0.629086 -0.208018 1.714635
H -0.662865 -1.582379 0.605236
H -2.530841 -1.842115 -1.049514
H -2.455383 1.506083 1.679526
H -4.902714 -1.346818 -1.581801
H -4.827508 1.991687 1.139586
H -6.055856 0.568029 -0.489485
H 2.499143 1.390207 -1.768155
H 5.263514 -0.694163 0.727057
H 3.435990 -1.689328 2.016004


%chk=000239462-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000239462

0 1
S 0.110397 0.609521 -0.708301
O 5.318844 0.776231 -1.146294
N 4.323515 -0.517948 0.540465
N 1.967418 -0.690466 0.856422
C -2.378458 -0.165597 0.312700
C -0.911366 -0.405484 0.568526
C -3.097535 -0.990456 -0.591083
C -3.064403 0.886450 0.973500
C 1.810191 0.173868 -0.234640
C -4.473414 -0.773552 -0.824410
C -4.440371 1.105381 0.741828
C -5.148933 0.275404 -0.157934
C 2.880647 0.703613 -0.954297
C 4.250495 0.376754 -0.598326
C 3.213651 -0.996324 1.194409
H -0.584478 -0.067596 1.562483
H -0.615485 -1.455812 0.431952
H -2.575218 -1.802442 -1.111185
H -2.517154 1.533134 1.669872
H -5.017273 -1.420127 -1.521925
H -4.958540 1.919160 1.261130
H -6.216579 0.443881 -0.337513
H 2.733200 1.375207 -1.802890
H 5.268769 -0.781629 0.837858
H 3.381378 -1.668270 2.042953


