%chk=000229823.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000229823

0 1
Cl 5.219635 1.505832 3.353304
S 1.728645 -1.872263 -1.829412
O -3.380235 1.921723 1.390939
O -5.046343 1.710405 -2.519693
O -1.281242 1.247219 -0.279017
O 1.717774 -2.115773 -3.251183
O 2.072838 -2.916361 -0.893580
N -1.425893 -0.888389 0.519161
N 2.824383 -0.554923 -1.655330
C -4.416201 0.591099 -0.414173
C -3.381110 0.649814 0.754933
C -4.089940 1.694835 -1.455681
C -4.352859 -0.794615 -1.070609
C -5.809303 0.845460 0.169840
C -1.941252 0.379206 0.273604
C -0.026906 -1.224492 0.159049
C 0.178852 -1.201488 -1.358810
C 3.418332 -0.104987 -0.446639
C 4.023040 1.173965 -0.437464
C 3.401430 -0.887206 0.724881
C 4.581520 1.669369 0.737993
C 3.959633 -0.384410 1.900068
C 4.536765 0.887346 1.896527
H -3.694382 -0.029331 1.583002
H -3.072449 1.588481 -1.873531
H -4.202948 2.706725 -1.018421
H -3.403138 -0.973680 -1.584266
H -4.503956 -1.599425 -0.343253
H -5.153035 -0.904807 -1.815849
H -5.800583 1.711667 0.848215
H -6.527877 1.074365 -0.631221
H -6.193961 -0.009201 0.732157
H 0.655066 -0.477346 0.641596
H 0.217964 -2.229030 0.581758
H -1.996217 -1.633631 0.902084
H -0.649393 -1.736559 -1.871776
H 0.040114 -0.146332 -1.711516
H -2.907583 2.592909 0.832258
H -4.992409 0.883877 -3.040023
H 3.164754 -0.087852 -2.508818
H 4.049202 1.778457 -1.341866
H 3.000393 -1.907204 0.721569
H 5.046225 2.656517 0.755969
H 3.952652 -0.985163 2.811226


%chk=000229823-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000229823

0 1
Cl 4.600616 1.267256 3.770353
S 1.866865 -2.047552 -1.980920
O -2.879954 2.371688 0.996808
O -4.886941 1.438346 -2.717244
O -0.793002 1.214337 -0.217324
O 1.869351 -2.415354 -3.558039
O 2.434182 -3.068233 -0.847711
N -1.438410 -0.932139 0.368727
N 2.939734 -0.376247 -1.806381
C -4.219690 0.777102 -0.379501
C -3.060486 0.959879 0.674509
C -3.865847 1.576348 -1.668481
C -4.439421 -0.719385 -0.718771
C -5.512072 1.357057 0.249689
C -1.684320 0.413249 0.229902
C -0.118047 -1.496891 0.025484
C 0.012387 -1.637396 -1.500237
C 3.260897 0.004149 -0.476961
C 2.669516 1.138460 0.154695
C 4.242276 -0.758353 0.220145
C 3.092500 1.537909 1.437919
C 4.640356 -0.382785 1.517579
C 4.067790 0.766102 2.103780
H -3.373843 0.449120 1.607767
H -2.867386 1.276972 -2.053654
H -3.846560 2.653184 -1.438725
H -3.618741 -1.145840 -1.327259
H -4.547691 -1.328912 0.200275
H -5.382444 -0.840174 -1.281412
H -5.319518 2.361666 0.662187
H -6.296424 1.434653 -0.523449
H -5.884414 0.710081 1.066712
H 0.654249 -0.814057 0.416944
H 0.004295 -2.473709 0.519414
H -2.172627 -1.545629 0.725383
H -0.553780 -2.479758 -1.929814
H -0.193204 -0.697233 -2.034864
H -2.036263 2.660150 0.544098
H -4.817347 0.539553 -3.125976
H 2.376863 0.327412 -2.321828
H 1.876946 1.701700 -0.351891
H 4.687760 -1.627795 -0.269527
H 2.658099 2.419003 1.918257
H 5.393750 -0.963128 2.057345


