%chk=000268679.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000268679

0 1
S -0.202406 1.894589 -0.000805
O -2.832108 -1.043024 -0.000623
O -3.183486 1.199172 -0.000647
O 2.256408 -2.248644 0.000095
O 3.586131 -0.542440 0.000319
N 2.473440 -1.048743 0.000125
C 1.393583 1.230701 -0.000513
C 1.322026 -0.156479 -0.000211
C -0.955446 0.328930 -0.000544
C -0.023461 -0.670626 -0.000236
C 2.576745 2.086782 -0.000621
C -2.410017 0.268508 -0.000654
C -4.271680 -1.252615 -0.000636
H -0.238788 -1.740112 -0.000039
H 3.228847 1.871081 0.872622
H 3.228412 1.871470 -0.874271
H 2.367075 3.165712 -0.000343
H -4.707617 -0.809990 -0.901964
H -4.707654 -0.809900 0.900630
H -4.347904 -2.345571 -0.000584


%chk=000268679-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000268679

0 1
S -0.194058 1.973752 -0.000733
O -2.848544 -1.088001 -0.000480
O -3.210797 1.226186 -0.000867
O 2.242083 -2.332910 0.000309
O 3.668388 -0.547539 -0.000087
N 2.479217 -1.061996 -0.000043
C 1.442700 1.240229 -0.000484
C 1.330420 -0.159211 -0.000275
C -0.961657 0.331449 -0.000532
C -0.010940 -0.673671 -0.000294
C 2.651398 2.126688 -0.000532
C -2.428141 0.242906 -0.000638
C -4.318666 -1.287202 -0.000592
H -0.251039 -1.736563 -0.000139
H 3.284764 1.920116 0.880499
H 3.284571 1.920283 -0.881748
H 2.371260 3.192974 -0.000416
H -4.764051 -0.830643 -0.900118
H -4.764231 -0.830333 0.898688
H -4.450576 -2.377712 -0.000418


