%chk=000187830.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000187830

0 1
S -3.783590 0.004690 0.662150
O -0.194911 0.018512 -0.854693
O 1.350477 -2.328245 -0.256004
O 1.369791 2.324292 -0.155273
O -0.974235 -0.025531 1.316519
N 1.101153 0.002746 -0.374321
C 3.164365 -0.791735 0.402733
C 3.170735 0.745703 0.436020
C 1.793779 -1.226673 -0.095463
C 1.803902 1.213166 -0.042642
C -1.213390 0.000745 0.145741
C -2.493279 0.022063 -0.614804
C -5.278747 0.038771 -0.343313
H 3.353921 -1.228948 1.404371
H 3.955591 -1.198203 -0.258150
H 3.965427 1.173815 -0.206803
H 3.363746 1.137570 1.455608
H -2.564003 0.923038 -1.261599
H -2.573471 -0.853075 -1.295118
H -6.138062 0.030238 0.344212
H -5.363997 -0.837749 -0.994748
H -5.350003 0.944612 -0.955121


%chk=000187830-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000187830

0 1
S -3.918312 -0.000127 0.795509
O -0.188699 0.020831 -0.882355
O 1.358881 -2.356866 -0.289904
O 1.380270 2.356782 -0.186240
O -0.888376 -0.029979 1.381733
N 1.140551 0.004009 -0.376319
C 3.211043 -0.799304 0.390683
C 3.218133 0.754131 0.424628
C 1.827158 -1.215169 -0.119001
C 1.838002 1.204474 -0.065473
C -1.189871 -0.001831 0.188579
C -2.538646 0.016541 -0.487173
C -5.347766 0.042217 -0.429260
H 3.366163 -1.250163 1.385321
H 3.978266 -1.219163 -0.281843
H 3.988878 1.195923 -0.229570
H 3.377590 1.159892 1.437807
H -2.612611 0.923247 -1.113583
H -2.620455 -0.866326 -1.145898
H -6.267828 0.039296 0.175133
H -5.333738 -0.849331 -1.076566
H -5.313434 0.960718 -1.036905


