%chk=000194471.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000194471

0 1
S 2.881130 0.545763 -0.385149
O 0.804199 2.168399 -0.174508
O -2.159538 0.005398 1.328930
N -0.943709 -0.550965 -0.516834
C 0.344437 -0.236874 0.132334
C 1.249037 -1.487099 0.197988
C 1.084763 0.882186 -0.640569
C 2.674986 -1.046994 0.484939
C -2.156217 -0.363801 0.168641
C -3.388696 -0.664678 -0.633667
H 0.127046 0.124623 1.181871
H 1.199892 -2.059285 -0.750166
H 0.878442 -2.179883 0.979932
H 0.851292 0.941571 -1.725799
H 2.865050 -0.905890 1.564190
H 3.425525 -1.764710 0.109577
H -0.916082 -0.862163 -1.480138
H 0.959400 2.264005 0.795289
H -4.284690 -0.537193 -0.001784
H -3.504378 0.016921 -1.487469
H -3.408790 -1.693729 -1.013709


%chk=000194471-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000194471

0 1
S 2.904938 0.748517 0.153756
O 0.420280 2.057276 -0.259335
O -1.912387 0.967510 0.822522
N -0.922296 -0.713546 -0.426734
C 0.413929 -0.418032 0.118976
C 1.403448 -1.590638 -0.006137
C 1.075707 0.823753 -0.533667
C 2.738625 -1.103569 0.599313
C -2.028895 -0.002702 -0.000170
C -3.377793 -0.436967 -0.548764
H 0.276013 -0.171423 1.191909
H 1.543784 -1.850468 -1.074797
H 1.031954 -2.487839 0.521894
H 1.163976 0.722186 -1.627864
H 2.738904 -1.195045 1.697654
H 3.604336 -1.640947 0.183360
H -1.026108 -1.457716 -1.118391
H -0.264965 1.928591 0.462277
H -4.044178 -0.689997 0.293537
H -3.838896 0.409639 -1.085526
H -3.317277 -1.302979 -1.229915


