%chk=000237639.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000237639

0 1
S 2.013119 -1.123124 -0.000803
N 0.260396 0.886332 -0.000227
N -2.184421 0.567703 -0.000213
N -1.227037 2.730660 0.002869
C -1.990567 -0.780453 -0.000301
C 0.387588 -0.462732 -0.000273
C -0.697703 -1.345271 -0.000223
C 3.111547 0.337746 -0.000278
C -3.209683 -1.637924 -0.000729
C -1.046515 1.365141 0.000212
C 4.521740 -0.207271 -0.000157
H -0.559642 -2.420814 -0.000153
H 2.900604 0.965780 -0.887563
H 2.900301 0.965378 0.887229
H -3.237974 -2.289177 0.885399
H -4.137822 -1.041575 0.001765
H -3.240135 -2.284908 -0.889938
H 4.734823 -0.822803 0.885404
H 4.735175 -0.822309 -0.885972
H 5.253958 0.613223 0.000226
H -0.435068 3.349785 -0.000920
H -2.155185 3.119612 -0.000755


%chk=000237639-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000237639

0 1
S 2.044480 -1.245590 -0.000919
N 0.253710 0.841346 0.000049
N -2.186703 0.582746 0.000260
N -1.179028 2.696397 0.000407
C -2.029229 -0.777857 -0.000212
C 0.376297 -0.511679 -0.000447
C -0.745834 -1.378423 -0.000418
C 3.131333 0.309079 -0.000173
C -3.291164 -1.613060 -0.000593
C -1.032042 1.327909 0.000672
C 4.605889 -0.120898 -0.000065
H -0.629115 -2.464809 -0.000613
H 2.863506 0.895050 -0.892889
H 2.863168 0.894381 0.892878
H -3.331620 -2.269913 0.887884
H -4.171660 -0.952553 0.002582
H -3.334401 -2.264627 -0.892851
H 4.854317 -0.718728 0.895000
H 4.854661 -0.718067 -0.895476
H 5.250535 0.777314 0.000385
H -0.352599 3.287322 -0.000546
H -2.117003 3.087657 -0.000314


