%chk=000240633.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000240633

0 1
S -1.146677 2.687013 1.863652
S 0.909001 0.647276 2.778623
O -0.240305 2.646606 0.724515
O -1.251546 3.869275 2.683255
O 1.831537 1.708603 3.097597
O 0.903803 -0.534061 3.620514
O -2.357175 -0.089620 -1.459922
O 3.525223 -1.807988 -0.751107
O -1.964675 -0.293433 0.761835
O 1.295271 -1.687133 -1.114551
C -0.748862 1.309832 2.861935
C -2.790536 2.379306 1.250344
C 1.094175 0.144702 1.109473
C -2.776346 1.817736 -0.160033
C 2.291002 -0.772221 0.942324
C -2.327943 0.377381 -0.187279
C 2.248672 -1.445201 -0.407465
C -1.856503 -1.451103 -1.725380
C 3.739635 -2.480382 -2.034270
C -2.853049 -2.475995 -1.236953
C 3.718967 -1.461508 -3.153457
H -0.953590 1.540394 3.933816
H -1.448475 0.452796 2.672595
H -3.371953 3.330410 1.261850
H -3.377495 1.721468 1.923070
H 1.177023 1.032861 0.425865
H 0.175927 -0.373220 0.728273
H -2.100118 2.414435 -0.827521
H -3.781949 1.901764 -0.630759
H 2.308376 -1.570649 1.728225
H 3.252188 -0.218107 1.061896
H -1.764325 -1.409135 -2.826302
H -0.856623 -1.550366 -1.253622
H 4.737439 -2.926967 -1.867182
H 2.970990 -3.263849 -2.153733
H -2.556898 -3.489069 -1.540070
H -2.922650 -2.474599 -0.138238
H -3.859774 -2.291623 -1.631417
H 4.028272 -1.905529 -4.107083
H 2.711984 -1.041803 -3.294220
H 4.392282 -0.619199 -2.944193


%chk=000240633-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000240633

0 1
S -1.441067 2.728127 2.085077
S 1.138184 0.907934 2.867866
O -0.484577 2.906381 0.763336
O -1.691547 3.957258 3.125457
O 1.962814 2.243102 3.288944
O 1.358657 -0.501283 3.686018
O -2.580150 0.054852 -1.574819
O 3.596243 -1.938639 -0.718191
O -1.918525 -0.214991 0.642773
O 1.333760 -1.505929 -1.078668
C -0.765629 1.218288 3.104270
C -3.231286 2.178868 1.422166
C 1.390446 0.501276 0.976096
C -3.140352 1.807447 -0.048805
C 2.509899 -0.530568 0.872880
C -2.489611 0.448047 -0.264937
C 2.382209 -1.346379 -0.406777
C -1.902860 -1.238574 -1.965985
C 3.635533 -2.822609 -1.930230
C -2.788270 -2.438066 -1.625484
C 3.931831 -1.999396 -3.185711
H -0.897987 1.465485 4.167615
H -1.266414 0.316074 2.727338
H -3.809011 3.095457 1.618588
H -3.532720 1.354824 2.086419
H 1.581087 1.489695 0.537035
H 0.415769 0.104002 0.653676
H -2.540275 2.558201 -0.599989
H -4.147102 1.809389 -0.506836
H 2.437200 -1.239268 1.727994
H 3.512830 -0.077191 0.924124
H -1.766959 -1.116571 -3.051893
H -0.921637 -1.285994 -1.465526
H 4.443357 -3.534275 -1.698569
H 2.669703 -3.351631 -2.008638
H -2.309593 -3.358790 -2.006928
H -2.909149 -2.545391 -0.534822
H -3.783399 -2.349339 -2.094921
H 4.046328 -2.675198 -4.053389
H 3.108472 -1.298195 -3.402107
H 4.868098 -1.427331 -3.069546


