%chk=000269283.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000269283

0 1
S 0.170411 -0.204657 0.051640
O -0.441185 2.799598 1.033841
O -1.601586 2.574043 -0.865665
C -1.309821 0.656532 0.684296
C -2.479854 -0.134114 0.182500
C 1.481796 0.398910 1.165965
C 2.750596 0.002822 0.486698
C -3.127888 -1.015541 1.064702
C -2.919414 -0.031040 -1.145827
C -1.196188 2.053211 0.141482
C 3.344305 0.858255 -0.455983
C 3.356611 -1.228215 0.786023
C -4.205001 -1.783734 0.617479
C -3.998717 -0.802328 -1.585297
C -4.642429 -1.679178 -0.707301
C 4.533605 0.485355 -1.086774
C 4.546266 -1.594516 0.151298
C 5.137401 -0.739517 -0.784146
H -1.297375 0.690419 1.805882
H 1.376403 -0.055314 2.169026
H 1.398496 1.498321 1.308265
H -2.791380 -1.108688 2.095696
H -2.427517 0.661020 -1.836259
H 2.874826 1.809326 -0.702344
H 2.898932 -1.901868 1.508487
H -4.704455 -2.466739 1.302848
H -4.336924 -0.717301 -2.617414
H -5.482037 -2.279456 -1.053066
H 4.989971 1.150487 -1.818441
H 5.012539 -2.550349 0.385417
H 6.063701 -1.027332 -1.277315
H -0.307390 3.736190 0.729388


%chk=000269283-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000269283

0 1
S 0.202425 -0.092712 -0.368501
O -0.568955 2.875449 1.016227
O -1.942781 2.706190 -0.847950
C -1.364813 0.676176 0.490947
C -2.594174 -0.117917 0.110581
C 1.534701 0.356661 0.944403
C 2.895289 -0.022387 0.412623
C -3.153103 -1.007118 1.064761
C -3.182633 -0.030254 -1.178474
C -1.369502 2.146422 0.109476
C 3.656636 0.901951 -0.349496
C 3.431676 -1.313596 0.656324
C -4.281109 -1.793056 0.743576
C -4.309104 -0.818879 -1.498283
C -4.862543 -1.701660 -0.541988
C 4.928772 0.546923 -0.849125
C 4.703725 -1.671370 0.156993
C 5.456644 -0.741297 -0.596831
H -1.160872 0.594482 1.570579
H 1.279328 -0.202519 1.860074
H 1.437370 1.438088 1.128792
H -2.702295 -1.084067 2.062064
H -2.768807 0.662458 -1.916402
H 3.246374 1.898427 -0.552342
H 2.848216 -2.038086 1.237420
H -4.703871 -2.472297 1.492149
H -4.756981 -0.742780 -2.495337
H -5.737287 -2.311161 -0.795082
H 5.507246 1.271224 -1.433442
H 5.106498 -2.670900 0.355231
H 6.443842 -1.017073 -0.984134
H -0.553217 3.829278 0.730267


