%chk=000246369.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000246369

0 1
S 3.618730 -0.121559 -0.084372
S -4.846844 0.743850 0.348841
O 3.839641 -0.055478 -1.759644
O 4.360659 0.986269 0.453807
O 3.976606 -1.477858 0.249670
O -3.118271 -1.261907 0.150919
N -2.211563 0.885687 0.244683
C 1.937126 0.149009 0.015432
C -0.819113 0.593995 0.166260
C 1.442573 1.457168 0.120855
C 1.045363 -0.932742 -0.012067
C 0.074000 1.691243 0.197410
C -0.328037 -0.721651 0.063764
C -3.241607 -0.067792 0.229822
C -5.964804 -0.667964 0.311591
H 2.139188 2.305370 0.149979
H 1.429279 -1.958792 -0.087093
H -0.295081 2.711463 0.279487
H -1.016368 -1.574691 0.042706
H -2.459543 1.881267 0.316154
H 4.613334 -0.518990 -2.107348
H -5.419892 -1.626018 0.228742
H -6.639476 -0.591013 -0.551215
H -6.560698 -0.700566 1.233217


%chk=000246369-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000246369

0 1
S 3.743908 -0.133879 -0.078095
S -4.921833 0.844826 0.361540
O 3.863758 -0.110293 -1.934702
O 4.519429 1.162701 0.503182
O 4.122679 -1.621248 0.434458
O -3.197684 -1.318793 0.158154
N -2.230529 0.830795 0.243741
C 1.903709 0.136919 0.004010
C -0.843932 0.544684 0.160572
C 1.435712 1.457572 0.106863
C 1.057594 -0.982745 -0.023907
C 0.046999 1.655212 0.189601
C -0.333619 -0.779913 0.058887
C -3.290135 -0.070942 0.236399
C -6.074824 -0.637664 0.325944
H 2.135666 2.297890 0.137112
H 1.473366 -1.992688 -0.092780
H -0.346962 2.674837 0.273654
H -1.021302 -1.626580 0.042292
H -2.481604 1.821241 0.315045
H 4.820197 -0.284154 -2.176243
H -5.439114 -1.535729 0.244702
H -6.733412 -0.548571 -0.548994
H -6.652866 -0.655181 1.260165


