%chk=000219641.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000219641

0 1
S -0.459796 0.314983 -0.617153
O 3.842319 -1.261407 0.332520
O 0.105679 -0.464556 -1.702513
O -0.452470 1.760010 -0.648802
O 3.115579 0.686930 1.242213
N 0.405975 -0.144076 0.813292
C -2.062072 -0.239020 -0.284846
C 1.523697 -1.090620 0.657653
C -2.983832 0.620996 0.320990
C -2.435758 -1.541543 -0.630597
C 2.875793 -0.405504 0.786907
C -4.280438 0.173921 0.591664
C -3.732211 -1.989571 -0.360503
C -4.652301 -1.131768 0.252562
C 5.233185 -0.796879 0.329786
C 5.450310 0.157267 -0.824102
H 0.640973 0.610563 1.482091
H 1.447287 -1.872667 1.455513
H 1.471876 -1.641359 -0.320905
H -2.696516 1.647884 0.574027
H -1.719864 -2.208397 -1.122766
H -4.999602 0.842472 1.063005
H -4.025399 -3.003270 -0.629753
H -5.663877 -1.481205 0.464137
H 5.450103 -0.339211 1.310915
H 5.767419 -1.757447 0.212011
H 6.512231 0.393892 -0.957875
H 5.078144 -0.260297 -1.769697
H 4.917969 1.107782 -0.663275


%chk=000219641-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000219641

0 1
S -0.503743 0.298048 -0.615245
O 3.986117 -1.266711 0.335192
O 0.047687 -0.585346 -1.876998
O -0.510426 1.926420 -0.617004
O 3.072459 0.724647 1.150514
N 0.462615 -0.295985 0.918886
C -2.255241 -0.284857 -0.235119
C 1.602438 -1.161382 0.553029
C -3.114696 0.620360 0.406349
C -2.626640 -1.577575 -0.635755
C 2.943103 -0.442703 0.710822
C -4.433854 0.187278 0.675584
C -3.950359 -1.989974 -0.357652
C -4.845665 -1.113044 0.299657
C 5.370740 -0.690499 0.429191
C 5.698272 0.127003 -0.821931
H 0.800247 0.594720 1.348702
H 1.599476 -2.063533 1.192417
H 1.494809 -1.505264 -0.498132
H -2.771209 1.627640 0.662615
H -1.918279 -2.223657 -1.163752
H -5.134597 0.865316 1.173331
H -4.279523 -2.990034 -0.658011
H -5.869300 -1.440739 0.510609
H 5.428154 -0.074569 1.343769
H 6.009081 -1.582484 0.526705
H 6.747673 0.472159 -0.772995
H 5.577416 -0.481515 -1.734323
H 5.047645 1.014183 -0.893955


