%chk=000290015.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000290015

0 1
S 1.235255 -1.331070 -1.091561
O -1.178469 1.428924 -0.107522
O -1.279389 -0.792319 -0.878043
N 3.836444 -1.047457 1.400262
C -0.639289 0.473863 -1.012180
C 0.834393 0.376166 -0.626182
C -2.528598 1.889176 -0.408166
C -1.564520 -1.281735 0.462861
C -2.757972 3.021054 0.573703
C -3.075757 -1.394543 0.577375
C 3.055427 -1.312077 -1.062690
C 3.495724 -1.168002 0.301905
H -0.834011 0.729150 -2.075411
H 0.984894 0.552491 0.458588
H 1.449058 1.125613 -1.150840
H -2.572893 2.217056 -1.459790
H -3.215842 1.030618 -0.245189
H -1.065128 -2.267197 0.496616
H -1.136128 -0.603576 1.220303
H -3.770141 3.430158 0.486211
H -2.614363 2.680558 1.608958
H -2.042227 3.838947 0.414605
H -3.377313 -1.777739 1.557470
H -3.554012 -0.411496 0.429789
H -3.481821 -2.064788 -0.191090
H 3.392336 -2.281815 -1.502231
H 3.469245 -0.514661 -1.717351


%chk=000290015-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000290015

0 1
S 1.201181 -1.375925 -1.501848
O -1.126532 1.669880 -0.132047
O -1.702011 -0.607254 -0.747054
N 3.596381 -1.442742 1.463895
C -0.792189 0.512549 -0.949953
C 0.674194 0.211423 -0.609525
C -2.402969 2.316857 -0.523300
C -1.699620 -1.192672 0.619911
C -2.634194 3.478017 0.440776
C -2.899126 -2.135798 0.693829
C 3.063294 -1.265895 -1.135323
C 3.369689 -1.370583 0.293751
H -0.921496 0.737804 -2.028758
H 0.807861 0.081107 0.476344
H 1.307785 1.041803 -0.961125
H -2.319241 2.672561 -1.572891
H -3.219766 1.570759 -0.472441
H -0.751917 -1.746278 0.777349
H -1.772886 -0.377306 1.365756
H -3.572065 4.005433 0.187692
H -2.708711 3.111405 1.479083
H -1.801346 4.200289 0.388549
H -2.938598 -2.627207 1.683230
H -3.842089 -1.583344 0.538219
H -2.823838 -2.917384 -0.081628
H 3.517675 -2.104020 -1.689904
H 3.455438 -0.318180 -1.542185


