%chk=000208174.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000208174

0 1
Cl 2.401897 3.142925 -1.243711
S -2.188743 0.317885 1.912779
O 0.752988 -1.884759 -0.292556
N 4.559887 -0.696201 0.436067
C 2.953131 -2.569024 0.147658
C 3.940999 -1.628983 -0.563567
C 1.774393 -1.821860 0.762386
C -0.368781 -1.083177 -0.122530
C -0.124990 0.356233 0.106453
C -2.870331 -1.109833 -0.337993
C -0.897395 1.102446 1.004726
C -1.541342 -1.715603 -0.321154
C -3.279695 -0.168368 0.617627
C 0.907131 0.998066 -0.601745
C 5.662857 -1.366662 1.186875
C 5.068712 0.534981 -0.238641
C -0.653745 2.460348 1.228299
C -3.798957 -1.509552 -1.320906
C -4.567130 0.373044 0.610517
C 1.137248 2.353172 -0.371899
C 0.380100 3.098292 0.538540
C -5.086900 -0.975173 -1.332441
C -5.476410 -0.037280 -0.366794
H 2.567524 -3.312224 -0.584335
H 3.471116 -3.150171 0.935462
H 3.385907 -1.032942 -1.321889
H 4.689369 -2.228344 -1.123964
H 2.009271 -0.772694 1.012013
H 1.349783 -2.336043 1.640201
H -1.521925 -2.796988 -0.507224
H 1.514533 0.431227 -1.311880
H 6.026626 -0.681935 1.969969
H 6.521243 -1.675254 0.572786
H 5.263867 -2.257571 1.697259
H 4.222459 1.062442 -0.709939
H 5.841340 0.363025 -1.001240
H 5.481491 1.216624 0.522623
H -1.267426 3.024295 1.934326
H -3.502647 -2.236296 -2.075929
H -4.863346 1.108634 1.359906
H 0.589571 4.155567 0.700691
H -5.796450 -1.288916 -2.097787
H -6.484331 0.372250 -0.380536


%chk=000208174-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000208174

0 1
Cl 3.046838 3.155530 0.357329
S -2.522896 0.328078 2.014623
O 0.965556 -1.824548 0.079593
N 4.102501 -0.672026 -0.354747
C 3.108472 -2.740474 0.738084
C 3.774825 -2.111526 -0.505897
C 1.889120 -1.956624 1.235028
C -0.191908 -1.020404 0.231500
C 0.013582 0.376224 0.698800
C -2.668120 -1.001254 -0.500440
C -0.964532 1.115351 1.423436
C -1.334191 -1.578549 -0.292604
C -3.304811 -0.092874 0.395914
C 1.246091 1.021090 0.374692
C 5.128494 -0.401139 0.674530
C 4.460922 -0.053641 -1.650949
C -0.733000 2.461162 1.786037
C -3.410029 -1.409468 -1.650500
C -4.595849 0.414993 0.134641
C 1.453604 2.349526 0.768966
C 0.486646 3.097026 1.468098
C -4.703893 -0.917717 -1.909673
C -5.302621 0.003110 -1.017400
H 2.803507 -3.770531 0.472751
H 3.825314 -2.825717 1.577986
H 3.067816 -2.197852 -1.350196
H 4.683250 -2.714519 -0.767023
H 2.187029 -0.957612 1.600254
H 1.364486 -2.499333 2.046572
H -1.184033 -2.583548 -0.710015
H 2.039021 0.463549 -0.144157
H 5.270978 0.689776 0.768586
H 6.118153 -0.866289 0.434678
H 4.801599 -0.782569 1.657184
H 3.644113 -0.212880 -2.377407
H 5.401619 -0.470358 -2.090381
H 4.594905 1.034445 -1.517049
H -1.509658 3.009309 2.327717
H -2.944379 -2.115200 -2.348589
H -5.047067 1.118249 0.842047
H 0.675019 4.134094 1.758886
H -5.244412 -1.249066 -2.803018
H -6.309162 0.389811 -1.209384


