%chk=000205683.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000205683

0 1
S 3.425301 -0.656465 1.489054
P 2.108336 -0.191007 0.205659
O 0.596473 -0.418771 0.758614
O 2.172456 -0.967399 -1.260457
O 2.062596 1.354039 -0.376515
C -1.616819 -1.192328 0.183678
C -2.619559 0.832900 0.489981
C -1.149377 1.254285 0.120184
C -0.495617 -0.151722 -0.175163
C -2.375034 -0.454830 1.326014
C -2.652056 -1.114955 -0.983029
C -3.342265 0.254867 -0.758446
C -1.110117 -2.580709 0.492040
C -0.501615 1.972317 1.307338
C -1.053944 2.148572 -1.116902
C 2.541175 -2.364247 -1.222359
C 3.337833 1.872272 -0.830775
H -3.181832 1.626974 0.992675
H -0.148974 -0.258278 -1.220776
H -1.757484 -0.298053 2.220753
H -3.293765 -0.958590 1.643745
H -3.371381 -1.944863 -0.919409
H -2.177192 -1.188147 -1.970395
H -3.253614 0.912696 -1.635668
H -4.418594 0.134751 -0.562475
H -0.351730 -2.547184 1.289977
H -0.649116 -3.050444 -0.382707
H -1.916571 -3.236832 0.838504
H 0.483399 2.380762 1.042745
H -0.348811 1.292908 2.157025
H -1.115908 2.808799 1.652837
H -0.001680 2.353974 -1.363050
H -1.543852 3.113130 -0.946574
H -1.518469 1.696063 -1.999682
H 2.532573 -2.636927 -2.288087
H 1.796016 -2.954632 -0.675310
H 3.549718 -2.503839 -0.808328
H 3.074981 2.897560 -1.130959
H 3.702508 1.307457 -1.697901
H 4.075511 1.899095 -0.016852


%chk=000205683-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000205683

0 1
S 3.613067 -0.712350 1.717708
P 2.219973 -0.231049 0.283167
O 0.601725 -0.310869 0.817981
O 2.300813 -1.138167 -1.208522
O 2.234684 1.347823 -0.429989
C -1.626451 -1.157898 0.146197
C -2.703975 0.821988 0.584591
C -1.263001 1.311982 0.159687
C -0.543485 -0.070388 -0.130749
C -2.391087 -0.503082 1.337729
C -2.678690 -1.012695 -1.012936
C -3.490166 0.276841 -0.639508
C -1.094873 -2.581186 0.330071
C -0.619383 2.097157 1.331736
C -1.232525 2.214937 -1.097251
C 2.720356 -2.556115 -1.160050
C 3.515152 1.829644 -0.997228
H -3.247577 1.590496 1.160020
H -0.147344 -0.128741 -1.162161
H -1.754393 -0.377931 2.229544
H -3.300920 -1.063627 1.619941
H -3.325969 -1.908623 -1.037720
H -2.188661 -0.938376 -2.002485
H -3.565824 0.999400 -1.469142
H -4.521076 0.018314 -0.334598
H -0.365719 -2.629272 1.156734
H -0.598034 -2.944420 -0.590953
H -1.924979 -3.276343 0.556019
H 0.428423 2.355431 1.103112
H -0.625247 1.527096 2.275325
H -1.182313 3.037149 1.487901
H -0.195127 2.544871 -1.288453
H -1.860649 3.113892 -0.951184
H -1.589433 1.694884 -2.004324
H 2.962481 -2.814910 -2.201927
H 1.895788 -3.191554 -0.790760
H 3.609069 -2.681287 -0.514282
H 3.317389 2.870299 -1.293766
H 3.797379 1.224829 -1.876573
H 4.314100 1.795045 -0.233899


