%chk=000248894.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000248894

0 1
S -1.329658 -0.748518 -0.209455
O 3.254819 -2.632429 -0.957521
O 0.386709 1.539939 0.838613
C 3.288714 -0.468187 0.001460
C 2.536474 0.623493 0.471334
C 1.109110 -1.680127 -0.576094
C 0.406535 -0.622779 -0.120545
C 2.615240 -1.685693 -0.550287
C 1.040655 0.600625 0.433833
C 4.684913 -0.423168 0.047004
C 3.186787 1.750514 0.982572
C -2.073670 0.776744 0.455503
C 0.475423 -2.903302 -1.130285
C -3.538141 0.525241 0.317014
C 5.333598 0.708802 0.560386
C 4.587377 1.791580 1.026419
C -4.251915 -0.085672 1.361144
C -4.211533 0.900696 -0.857065
C -5.624236 -0.312929 1.231102
C -5.583979 0.670460 -0.980421
C -6.292707 0.064706 0.062084
H 5.262059 -1.277550 -0.320915
H 2.593067 2.595194 1.345946
H -1.757346 0.951138 1.504197
H -1.728065 1.667905 -0.107218
H -0.180199 -3.395056 -0.391994
H -0.148760 -2.677656 -2.011307
H 1.221824 -3.652784 -1.447845
H 6.423361 0.738514 0.593519
H 5.089987 2.673008 1.426130
H -3.736180 -0.385763 2.272083
H -3.664353 1.368902 -1.673904
H -6.173907 -0.786553 2.043009
H -6.102266 0.963286 -1.892168
H -7.361639 -0.113080 -0.036426


%chk=000248894-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000248894

0 1
S -1.290800 -0.623272 -0.766127
O 3.332606 -2.859641 -0.290752
O 0.502520 1.835305 -0.022109
C 3.351913 -0.494371 0.175614
C 2.611747 0.714583 0.267299
C 1.207399 -1.746064 -0.481017
C 0.484775 -0.561781 -0.364731
C 2.673067 -1.769028 -0.212821
C 1.147277 0.738133 -0.033471
C 4.739292 -0.492886 0.452043
C 3.263558 1.916526 0.635873
C -2.155619 0.839861 0.169662
C 0.561845 -3.053185 -0.866862
C -3.634301 0.547243 0.181763
C 5.385260 0.706338 0.820552
C 4.646641 1.912500 0.912533
C -4.205088 -0.273831 1.189903
C -4.481021 1.091978 -0.818510
C -5.591781 -0.537595 1.203053
C -5.868952 0.827927 -0.808525
C -6.427975 0.012574 0.202728
H 5.284854 -1.438300 0.371646
H 2.670374 2.834333 0.694674
H -1.712739 0.862447 1.176407
H -1.889269 1.759174 -0.365043
H -0.349663 -3.234016 -0.266240
H 0.241509 -3.042782 -1.926944
H 1.276001 -3.879497 -0.730200
H 6.459339 0.705888 1.034575
H 5.150326 2.842429 1.196771
H -3.558278 -0.704870 1.963600
H -4.049849 1.725962 -1.602624
H -6.020542 -1.168686 1.989431
H -6.511856 1.257695 -1.584644
H -7.504472 -0.191591 0.212395


