%chk=000291158.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000291158

0 1
S -1.263128 -0.820431 -1.081857
O -0.955676 -2.229427 -1.254050
O -1.142337 0.089915 -2.205676
O 4.462330 0.554639 0.363018
C -2.870763 -0.669789 -0.436340
C -0.255093 -0.195620 0.243311
C -4.960353 0.550544 -0.195972
C -3.640268 0.427867 -0.731103
C -5.469509 -0.485848 0.631315
C -3.388126 -1.719745 0.372547
C -4.652296 -1.630187 0.899034
C -5.780459 1.690034 -0.477823
C 1.122019 -0.754735 0.129032
C -6.790464 -0.361089 1.169628
C -7.042912 1.782800 0.050387
C -7.552656 0.743785 0.885158
C 2.221280 0.004158 0.125387
C 3.597604 -0.566655 -0.004512
C 5.824526 0.362953 0.314667
C 6.466276 -0.823240 -0.059827
C 6.546621 1.515360 0.693165
C 7.866727 -0.847968 -0.052998
C 7.935522 1.457922 0.689475
C 8.601095 0.278783 0.317775
H -0.668658 -0.453980 1.241282
H -0.240892 0.915659 0.237997
H -3.262372 1.222423 -1.386944
H -2.770984 -2.606490 0.551147
H -5.057459 -2.429728 1.518140
H -5.382007 2.475908 -1.119914
H 1.168362 -1.847662 0.048653
H -7.174535 -1.159169 1.803649
H -7.675725 2.644602 -0.158007
H -8.559978 0.846667 1.289618
H 2.199038 1.095007 0.208937
H 3.827062 -0.863363 -1.046217
H 3.794096 -1.401658 0.691847
H 5.912639 -1.707204 -0.352522
H 6.008089 2.415870 0.975697
H 8.383876 -1.762825 -0.342690
H 8.513383 2.336222 0.977394
H 9.687104 0.247797 0.319092


%chk=000291158-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000291158

0 1
S -1.168559 -1.523322 -0.468584
O -1.112420 -3.157834 -0.564361
O -0.630101 -0.560414 -1.679896
O 4.372853 0.544349 0.591758
C -2.962406 -1.030078 -0.102189
C -0.132164 -0.978551 1.197992
C -4.746210 0.607335 -0.234683
C -3.386168 0.231585 -0.493294
C -5.627022 -0.343231 0.419230
C -3.799439 -1.996319 0.519724
C -5.125192 -1.640457 0.775743
C -5.255948 1.894871 -0.606924
C 1.300950 -1.233382 0.948100
C -6.985078 0.038017 0.677640
C -6.583573 2.235574 -0.340061
C -7.453636 1.300602 0.307721
C 2.131739 -0.291536 0.417354
C 3.559112 -0.556517 0.038273
C 5.742326 0.561947 0.264347
C 6.391142 -0.419665 -0.525698
C 6.473042 1.656158 0.791514
C 7.776951 -0.292579 -0.782979
C 7.851785 1.766725 0.526195
C 8.513749 0.793526 -0.263570
H -0.606045 -1.608820 1.964425
H -0.412584 0.082197 1.283546
H -2.703193 0.911667 -1.015777
H -3.406588 -2.991941 0.749687
H -5.802964 -2.359740 1.249500
H -4.588350 2.607150 -1.105181
H 1.672586 -2.246795 1.146079
H -7.653371 -0.678419 1.169530
H -6.967049 3.220595 -0.626527
H -8.492703 1.582313 0.509471
H 1.762310 0.720944 0.208192
H 3.660084 -0.561505 -1.069216
H 3.910087 -1.532658 0.429526
H 5.844121 -1.273088 -0.937406
H 5.944065 2.397579 1.398342
H 8.277468 -1.052041 -1.394318
H 8.411735 2.614826 0.935907
H 9.585660 0.883034 -0.468232


