%chk=000275665.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000275665

0 1
S 2.569857 0.419545 0.613577
O 3.556517 1.285694 0.026519
O 2.296429 0.438668 2.033618
O 0.650205 1.838963 -0.594860
O -4.545333 0.561783 0.833608
O -4.093130 -0.916971 -0.786271
N 0.086095 -0.338550 -0.217555
C 1.840194 -2.069910 -0.330638
C 0.502435 -1.662856 0.306767
C 3.011348 -1.244982 0.178773
C 0.952211 0.743807 -0.169442
C -1.293233 -0.175148 -0.729982
C -2.261890 0.201451 0.404867
C -3.671327 -0.143260 0.041527
H 2.026951 -3.146515 -0.128011
H 1.768107 -1.994368 -1.437780
H -0.279449 -2.421637 0.076223
H 0.579500 -1.629539 1.421256
H 3.466837 -1.740882 1.065590
H 3.835060 -1.247218 -0.568290
H -1.292967 0.632381 -1.505513
H -1.625204 -1.111503 -1.236230
H -2.171415 1.287208 0.649974
H -1.994274 -0.308988 1.357742
H -5.499424 0.359026 0.631730


%chk=000275665-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000275665

0 1
S 2.674563 0.442520 0.696750
O 3.778803 1.531973 0.201292
O 2.379523 0.186962 2.299248
O 0.590711 1.903513 -0.730990
O -4.645681 0.576492 0.848455
O -4.142809 -0.577425 -1.105499
N 0.065539 -0.340678 -0.184968
C 1.842586 -2.127746 -0.296713
C 0.575885 -1.602675 0.431967
C 3.129543 -1.324833 -0.005387
C 0.820426 0.788774 -0.247403
C -1.335045 -0.284110 -0.694795
C -2.325548 0.125597 0.416369
C -3.760471 -0.010279 -0.057690
H 2.002594 -3.175005 0.019376
H 1.636805 -2.138205 -1.382147
H -0.230607 -2.348022 0.340654
H 0.785533 -1.437112 1.505203
H 3.733715 -1.737707 0.817437
H 3.745071 -1.121263 -0.893342
H -1.375472 0.441157 -1.524352
H -1.600053 -1.274104 -1.102497
H -2.148443 1.164268 0.746608
H -2.201641 -0.511072 1.313903
H -5.581428 0.465178 0.525720


