%chk=000200523.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000200523

0 1
Cl -2.384175 -3.702768 0.553644
S 1.672745 -0.229483 1.850035
P 2.219363 -0.472780 0.050471
O 1.033626 -0.333400 -1.126032
O 2.754605 -1.956942 -0.376727
O 3.361575 0.475406 -0.613060
O -4.795104 -2.500209 0.169320
O -5.075651 -0.362220 0.067772
N -0.079375 2.595073 -0.527181
N -4.379223 -1.367354 0.026007
C -0.808019 1.743428 -1.530307
C -1.218521 0.403044 -0.980422
C -0.795209 2.667210 0.790074
C 0.200031 3.942121 -1.118238
C -0.260790 -0.619562 -0.755945
C -2.550456 0.114459 -0.706040
C 0.048437 3.398564 1.833772
C -1.014232 4.824780 -1.414212
C -2.941711 -1.158322 -0.233618
C -0.623920 -1.891884 -0.298007
C -1.970740 -2.151992 -0.030941
C 3.893437 -2.486728 0.385039
C 3.311962 1.910023 -0.311829
C 4.065549 -3.874707 -0.198879
C 4.152989 2.197563 0.914340
H -1.695968 2.259395 -1.963537
H -0.091112 1.574419 -2.374005
H -0.956273 1.620484 1.140911
H -1.797402 3.139329 0.707928
H 0.880748 4.471664 -0.413642
H 0.784656 3.782876 -2.051921
H -3.325847 0.880809 -0.847174
H -0.399480 3.293371 2.829316
H 0.142213 4.468277 1.623046
H 1.060319 2.973488 1.891260
H -0.706810 5.779237 -1.856302
H -1.578994 5.056829 -0.503279
H -1.708311 4.350593 -2.116928
H 0.125749 -2.678645 -0.158858
H 3.640830 -2.515478 1.463142
H 4.773509 -1.842400 0.197139
H 3.765129 2.319918 -1.238446
H 2.266236 2.269299 -0.221539
H 3.190450 -4.507466 0.004289
H 4.170177 -3.831239 -1.293562
H 4.951168 -4.375800 0.208367
H 3.628175 1.965713 1.853286
H 5.080112 1.607879 0.910930
H 4.438734 3.255830 0.958144


%chk=000200523-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000200523

0 1
Cl -2.265949 -3.898077 0.701821
S 1.903160 -0.355819 2.185644
P 2.315706 -0.498958 0.171450
O 0.985075 -0.225466 -0.947699
O 2.834478 -2.014053 -0.448244
O 3.473522 0.553827 -0.523399
O -4.872874 -2.787592 -0.047206
O -5.239907 -0.546003 0.143686
N -0.312706 2.638564 -0.417390
N -4.460352 -1.568855 -0.015729
C -1.021057 1.786003 -1.410999
C -1.349422 0.395975 -0.890363
C -1.138806 2.933476 0.784805
C 0.319095 3.824293 -1.060478
C -0.337796 -0.572026 -0.640231
C -2.679012 0.003599 -0.660646
C -0.339246 3.588223 1.924953
C -0.637962 4.877276 -1.682831
C -3.016688 -1.292605 -0.199541
C -0.648643 -1.866618 -0.170053
C -1.987659 -2.236069 0.051180
C 4.025482 -2.676203 0.181733
C 3.411027 2.018092 -0.169397
C 4.102923 -4.069710 -0.431453
C 4.436415 2.345029 0.914189
H -1.973309 2.251790 -1.765299
H -0.353315 1.691592 -2.287930
H -1.535470 1.968648 1.149443
H -2.027891 3.566001 0.535410
H 0.958372 4.322206 -0.308212
H 0.997484 3.443636 -1.849350
H -3.499496 0.707858 -0.827374
H -0.973443 3.668609 2.826345
H 0.003496 4.607764 1.671599
H 0.540591 2.969317 2.177571
H -0.048815 5.697870 -2.132427
H -1.307731 5.323130 -0.925391
H -1.264649 4.440451 -2.481173
H 0.153705 -2.589838 0.002664
H 3.876974 -2.709768 1.278297
H 4.918975 -2.069478 -0.053158
H 3.644627 2.514610 -1.126014
H 2.377461 2.273797 0.129906
H 3.195142 -4.652225 -0.200835
H 4.213355 -4.008169 -1.526937
H 4.977627 -4.606827 -0.020619
H 4.183080 1.843123 1.863369
H 5.448434 2.033979 0.602709
H 4.451196 3.437319 1.091208


