%chk=000185312.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000185312

0 1
Cl 5.048157 1.248181 -1.197573
S -0.820106 1.517619 0.896522
O -2.317505 -1.153991 1.861495
N -0.630418 -1.960193 0.509765
N -0.575090 -3.187236 1.130770
N 1.110001 -3.050266 -0.425565
C -3.157026 0.703290 -0.350259
C -1.698359 0.227199 -0.041183
C -3.937253 -0.508165 -0.893681
C -3.849276 1.246159 0.903523
C -3.089826 1.794859 -1.431310
C -1.648744 -0.962162 0.887409
C 0.818182 1.387581 0.264887
C 1.145123 2.016215 -0.940149
C 1.781238 0.721278 1.027929
C 0.430114 -1.899949 -0.453691
C 2.463586 1.972097 -1.401348
C 3.103524 0.675246 0.574655
C 0.464790 -3.835333 0.564885
C 3.422160 1.301561 -0.633845
H -1.197481 0.035261 -1.018801
H -4.091427 -1.275731 -0.124030
H -3.439981 -0.981425 -1.745227
H -4.936389 -0.209806 -1.234205
H -3.424622 2.196700 1.246630
H -3.790285 0.538467 1.745321
H -4.914667 1.428270 0.720330
H -2.512411 2.666900 -1.101396
H -4.095336 2.159977 -1.675397
H -2.647350 1.432418 -2.363809
H 0.385041 2.545993 -1.517797
H 1.513406 0.238670 1.972124
H 0.629754 -1.041567 -1.079114
H 2.743100 2.455725 -2.337815
H 3.871217 0.156945 1.151779
H 0.793855 -4.836491 0.813070


%chk=000185312-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000185312

0 1
Cl 5.075721 1.457252 -1.573159
S -0.761060 1.350233 1.203409
O -2.671388 -1.496161 1.680057
N -0.700256 -2.091937 0.563600
N -0.610351 -3.308230 1.279404
N 1.115188 -3.127812 -0.275654
C -3.158270 0.719648 -0.337543
C -1.767478 0.131077 0.065497
C -3.943916 -0.387971 -1.100109
C -3.984511 1.202974 0.883703
C -2.914759 1.914842 -1.298037
C -1.803045 -1.181924 0.844286
C 0.880371 1.338719 0.369291
C 1.042665 1.866349 -0.935987
C 2.004094 0.856016 1.082460
C 0.354506 -2.023919 -0.358283
C 2.320864 1.895018 -1.536787
C 3.289999 0.896807 0.496838
C 0.488313 -3.875705 0.733892
C 3.426624 1.411145 -0.807174
H -1.151653 0.036117 -0.843806
H -4.199126 -1.232236 -0.437555
H -3.368907 -0.775033 -1.963645
H -4.887574 0.034811 -1.489717
H -3.460543 2.011430 1.426380
H -4.182256 0.378961 1.587309
H -4.951453 1.608419 0.532989
H -2.327883 2.710632 -0.804548
H -3.883216 2.347716 -1.606578
H -2.382143 1.595443 -2.215476
H 0.182439 2.273749 -1.477336
H 1.875258 0.443426 2.087681
H 0.538555 -1.193036 -1.031645
H 2.454872 2.301690 -2.543189
H 4.161113 0.522421 1.041276
H 0.848903 -4.846636 1.063053


