%chk=000298842.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000298842

0 1
S -0.320486 0.007506 -1.310249
S 2.900666 -0.124634 -2.591744
P 1.734820 -0.075447 -1.077418
O 1.914759 1.199311 -0.039095
O 1.798050 -1.360159 -0.038327
C -0.904118 0.035034 0.440279
C -2.387305 0.095034 0.302768
C -3.138661 -1.089886 0.238698
C -3.040279 1.336712 0.235571
C 3.207936 1.878483 0.011294
C 3.054338 -2.097607 0.079346
C -4.528800 -1.029936 0.113760
C -4.430731 1.389169 0.110655
C -5.177046 0.207808 0.050728
C 2.994712 2.930880 1.084044
C 2.718577 -3.177740 1.091436
H -0.483944 0.911851 0.975279
H -0.556449 -0.870983 0.978815
H 3.997657 1.157215 0.287925
H 3.421617 2.330034 -0.977602
H 3.326054 -2.523127 -0.906906
H 3.846902 -1.419289 0.443149
H -2.638452 -2.056726 0.279733
H -2.463487 2.259990 0.274208
H -5.108134 -1.950703 0.062984
H -4.933636 2.353673 0.057480
H 3.884707 3.556781 1.213347
H 2.150714 3.587279 0.828077
H 2.752079 2.472129 2.051702
H 3.569739 -3.846599 1.260715
H 2.423544 -2.744024 2.056064
H 1.869590 -3.786515 0.748638
H -6.260136 0.251587 -0.047153


%chk=000298842-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000298842

0 1
S -0.230339 0.004013 -1.551386
S 3.303195 -0.272217 -2.656542
P 1.970013 -0.261645 -1.077090
O 2.305630 0.907263 0.188607
O 1.859821 -1.656415 -0.050028
C -0.925264 -0.111974 0.256686
C -2.419846 0.064986 0.185988
C -3.267903 -1.058071 -0.004881
C -3.004258 1.353705 0.303797
C 2.802275 2.252171 -0.215171
C 3.133500 -2.200296 0.516357
C -4.669217 -0.897738 -0.066441
C -4.405670 1.515618 0.242772
C -5.242157 0.389833 0.057747
C 3.152411 2.984625 1.077482
C 2.747393 -3.457953 1.287960
H -0.419984 0.679824 0.829477
H -0.621094 -1.100427 0.628756
H 3.682558 2.127572 -0.874168
H 2.004949 2.775128 -0.778649
H 3.824771 -2.423289 -0.318947
H 3.584374 -1.431823 1.171523
H -2.824259 -2.055711 -0.105800
H -2.357004 2.227804 0.444233
H -5.312876 -1.772605 -0.210127
H -4.844714 2.514770 0.339621
H 3.522049 3.999887 0.842112
H 2.267643 3.078136 1.730048
H 3.940151 2.445633 1.630773
H 3.651284 -3.914555 1.732273
H 2.042540 -3.217722 2.102089
H 2.274537 -4.196125 0.618540
H -6.329715 0.514701 0.010589


