%chk=000199043.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000199043

0 1
S 3.223864 0.808737 0.336027
N -0.424000 1.958021 0.625325
N 0.571201 0.017358 0.078699
N 0.914202 2.204055 0.715744
N -4.475685 -1.193384 -0.294296
C -1.957775 0.007127 0.044984
C -0.640458 0.617911 0.234191
C -2.143374 -1.348549 0.354252
C -3.038540 0.756576 -0.444715
C 1.503976 1.018938 0.378050
C 3.398936 -0.927461 -0.197971
C -3.418006 -1.908218 0.169301
C -4.279124 0.115535 -0.597108
C 4.831645 -1.036978 -0.590465
C 5.773216 -1.544158 0.204549
H -1.096388 2.679355 0.846811
H -1.311051 -1.952823 0.719660
H -2.927044 1.800727 -0.723407
H 3.109944 -1.610304 0.624907
H 2.713019 -1.154744 -1.040572
H -3.612376 -2.964422 0.396246
H -5.154041 0.658449 -0.976533
H 5.065436 -0.668258 -1.593472
H 6.811404 -1.623694 -0.087001
H 5.585423 -1.914696 1.202895


%chk=000199043-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000199043

0 1
S 3.354344 1.288971 1.060996
N -0.325891 2.169120 0.197102
N 0.790107 0.259457 0.453563
N 0.975412 2.577305 0.500747
N -3.989057 -1.529008 -0.663818
C -1.652610 0.029786 -0.115721
C -0.434028 0.791241 0.170187
C -1.610272 -1.389654 -0.089312
C -2.893507 0.649578 -0.423546
C 1.604918 1.366458 0.646131
C 3.550894 -0.620047 1.154496
C -2.787520 -2.114015 -0.366332
C -4.017477 -0.162683 -0.686123
C 3.681954 -1.251666 -0.201265
C 4.804567 -1.870976 -0.647153
H -1.031647 2.884275 0.035170
H -0.671057 -1.897934 0.144805
H -3.005229 1.739021 -0.464624
H 4.449523 -0.760181 1.777196
H 2.656306 -0.975083 1.690176
H -2.784067 -3.209348 -0.353178
H -4.986276 0.289465 -0.925948
H 2.786225 -1.201344 -0.833927
H 4.846561 -2.332629 -1.639776
H 5.712231 -1.935010 -0.033742


