%chk=000291711.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000291711

0 1
S -0.605599 1.558266 0.008265
O -1.304372 2.486559 0.900950
O -0.126214 2.015017 -1.274513
N 0.745078 1.095965 0.977638
N -2.934903 0.574235 1.779155
C -1.523635 0.141022 -0.167839
C -2.580839 -0.214744 0.700390
C 1.891180 0.384840 0.538417
C -1.204839 -0.726988 -1.237373
C -3.283849 -1.445378 0.494828
C -1.888409 -1.911083 -1.436505
C -2.932871 -2.269295 -0.553198
C 2.200259 0.255080 -0.829529
C 2.726280 -0.209907 1.511633
C 3.318955 -0.486643 -1.210085
C 3.840424 -0.942128 1.105209
C 4.139052 -1.092614 -0.253286
H 0.759266 1.385893 1.964182
H -0.398269 -0.445620 -1.926714
H -4.088196 -1.723013 1.170095
H -1.632558 -2.568960 -2.262580
H 1.609623 0.766893 -1.594469
H 2.503185 -0.103168 2.568939
H -3.464946 -3.209769 -0.713449
H 3.558207 -0.585342 -2.269351
H 4.483383 -1.402452 1.855337
H -3.765234 0.357996 2.306256
H -2.595848 1.544230 1.868520
H 5.006488 -1.668692 -0.561722


%chk=000291711-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000291711

0 1
S -0.657321 1.754630 -0.239659
O -1.557268 2.840051 0.598044
O -0.143510 2.048678 -1.747360
N 0.969835 1.622637 0.857386
N -2.671990 0.627584 1.908358
C -1.540955 0.096692 -0.224538
C -2.393557 -0.247062 0.870202
C 1.894636 0.617258 0.461922
C -1.259316 -0.768480 -1.299099
C -2.947671 -1.566582 0.831226
C -1.830953 -2.055721 -1.308799
C -2.665837 -2.444275 -0.229231
C 2.619705 0.804030 -0.749855
C 2.143381 -0.533812 1.263883
C 3.581263 -0.148262 -1.141159
C 3.135271 -1.459988 0.880024
C 3.850537 -1.276626 -0.327472
H 0.589783 1.497399 1.815331
H -0.613172 -0.419491 -2.111714
H -3.612494 -1.879590 1.645120
H -1.629438 -2.741342 -2.136412
H 2.422674 1.695843 -1.351428
H 1.569332 -0.688217 2.186557
H -3.113265 -3.444540 -0.223405
H 4.136626 -0.001731 -2.073940
H 3.338973 -2.331088 1.512438
H -3.314314 0.337819 2.641911
H -2.462163 1.628080 1.780634
H 4.612007 -2.003695 -0.629764


