%chk=000262768.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000262768

0 1
S -1.075230 0.905373 1.084779
O -3.213742 -1.499930 1.327378
O -4.153626 0.316976 2.297731
C 0.244270 0.437862 -0.135677
C 0.524729 1.655917 -0.994100
C 1.365589 0.151518 0.848832
C -0.171399 -0.762560 -0.951751
C 1.846535 2.078805 -1.211652
C 1.714536 1.134767 1.793996
C 0.069952 -0.807427 -2.333951
C -0.522091 2.355843 -1.615476
C 2.058794 -1.067574 0.842480
C -0.777425 -1.869708 -0.331612
C -2.697729 0.568538 0.353923
C 2.112619 3.195892 -2.007911
C 2.715779 0.882250 2.734383
C -0.302304 -1.927366 -3.083538
C -0.252760 3.473471 -2.410053
C 3.065989 -1.311075 1.781064
C -1.148250 -2.986198 -1.083453
C 1.064081 3.900050 -2.605852
C 3.392260 -0.341826 2.733162
C -0.913858 -3.018737 -2.461994
C -3.439911 -0.143569 1.440943
C -3.814879 -2.345867 2.344416
H 2.679591 1.537416 -0.760355
H 1.219842 2.109101 1.794729
H 0.555350 0.029874 -2.838478
H -1.554905 2.037976 -1.492123
H 1.823063 -1.835705 0.104681
H -0.974991 -1.864079 0.746020
H -3.206231 1.521599 0.096405
H -2.634130 -0.039739 -0.573647
H 3.142004 3.516616 -2.161278
H 2.970044 1.644056 3.470105
H -0.111268 -1.946631 -4.155382
H -1.074367 4.013948 -2.877789
H 3.596088 -2.262182 1.768231
H -1.624708 -3.832645 -0.591063
H 1.270888 4.773294 -3.221202
H 4.170710 -0.536616 3.468197
H -1.204950 -3.889630 -3.046048
H -3.226378 -2.255948 3.262898
H -3.739793 -3.345168 1.904991
H -4.855488 -2.052163 2.520541


%chk=000262768-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000262768

0 1
S -0.935559 -0.329435 1.433149
O -4.384959 -0.755008 1.858828
O -4.018014 0.916717 0.278393
C 0.433825 -0.024557 0.023708
C 0.271693 1.360735 -0.639829
C 1.730286 -0.052447 0.864445
C 0.312195 -1.180869 -0.982719
C 1.416974 1.960476 -1.232463
C 1.860881 0.869102 1.940265
C 0.118797 -0.949070 -2.368121
C -0.972031 2.027961 -0.754146
C 2.822135 -0.906471 0.572372
C 0.375135 -2.529141 -0.528526
C -2.452741 -0.990620 0.473661
C 1.321757 3.192719 -1.914170
C 3.033933 0.910692 2.720180
C -0.000819 -2.030203 -3.274462
C -1.067847 3.262876 -1.436854
C 4.004659 -0.856997 1.347117
C 0.260274 -3.605493 -1.429910
C 0.075354 3.852156 -2.021003
C 4.114508 0.044774 2.427924
C 0.071688 -3.361419 -2.812716
C -3.670314 -0.162283 0.815941
C -5.577658 -0.006201 2.325498
H 2.389814 1.463324 -1.152746
H 1.038786 1.560952 2.157266
H 0.065145 0.076251 -2.745232
H -1.875355 1.610639 -0.300516
H 2.759565 -1.606830 -0.265753
H 0.493504 -2.722486 0.543619
H -2.226913 -0.911385 -0.599844
H -2.592656 -2.042232 0.759292
H 2.220393 3.637505 -2.356726
H 3.109039 1.622159 3.550135
H -0.152624 -1.825310 -4.340175
H -2.041765 3.760353 -1.504536
H 4.839395 -1.522968 1.100542
H 0.310967 -4.634109 -1.055333
H -0.000937 4.811698 -2.544854
H 5.029537 0.079021 3.029783
H -0.022969 -4.197622 -3.514445
H -5.281777 0.995061 2.680828
H -5.987262 -0.614511 3.143591
H -6.305737 0.101296 1.504042


