%chk=000208699.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000208699

0 1
Cl 5.264250 2.226766 1.116878
S 0.469182 -0.923176 -1.347730
O -3.376415 3.270958 0.317715
O 1.169247 -1.835304 -2.263137
O -0.461007 -0.024093 -2.014802
N -0.779192 0.966790 0.552322
N -3.066912 2.381694 -0.579302
C 0.344029 0.584294 1.460999
C -2.146195 0.813893 1.153434
C -0.638963 2.384987 0.061587
C -3.161093 0.959073 0.007650
C -1.631288 2.581444 -1.092305
C 0.198984 -0.848236 2.017398
C 1.634441 0.631506 0.651782
C -4.019659 2.472750 -1.769122
C -0.471985 -1.880197 1.148858
C 1.761928 -0.054336 -0.556813
C -0.369678 -1.974864 -0.238367
C 2.722627 1.346446 1.178552
C 2.988662 -0.041071 -1.238855
C -1.226868 -2.848069 1.854084
C -1.010970 -3.041590 -0.903155
C 3.926286 1.348982 0.474705
C 4.083572 0.660161 -0.730166
C -1.862193 -3.888343 1.185488
C -1.753799 -3.990037 -0.207957
H 0.423486 1.281269 2.341290
H -2.260941 -0.186343 1.615607
H -2.363032 1.579753 1.936531
H -0.842288 3.136561 0.860475
H 0.390544 2.555729 -0.316779
H -4.188235 0.802930 0.392317
H -2.952478 0.212562 -0.789461
H -1.410205 1.841993 -1.905535
H -1.538411 3.606081 -1.501983
H 1.210872 -1.235286 2.287509
H -0.334932 -0.779378 2.992423
H -3.779956 1.744713 -2.552536
H -5.055264 2.324372 -1.426572
H -3.981490 3.490165 -2.190530
H 2.633290 1.892905 2.116963
H 3.095604 -0.599706 -2.183466
H -1.311127 -2.782666 2.937833
H -0.912820 -3.141680 -1.993771
H 5.035757 0.669656 -1.260781
H -2.441302 -4.625933 1.742645
H -2.240664 -4.805724 -0.739319


%chk=000208699-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000208699

0 1
Cl 5.357795 2.250709 1.303593
S 0.501152 -1.002388 -1.502027
O -3.284051 3.427862 0.504005
O 1.355616 -2.044687 -2.444489
O -0.535919 -0.066742 -2.348801
N -0.817107 0.992092 0.490566
N -3.104105 2.487233 -0.562033
C 0.292233 0.612902 1.388135
C -2.179653 0.839182 1.069587
C -0.656175 2.361696 -0.079207
C -3.230936 1.051381 -0.021369
C -1.696140 2.622711 -1.167710
C 0.086242 -0.797367 2.017631
C 1.625688 0.659547 0.639329
C -4.148795 2.728108 -1.633519
C -0.492011 -1.929813 1.166997
C 1.857804 -0.032989 -0.567064
C -0.383617 -2.137243 -0.227515
C 2.724425 1.355214 1.201000
C 3.104531 -0.065206 -1.214436
C -1.192216 -2.946372 1.881980
C -0.918796 -3.263250 -0.889960
C 3.975369 1.337443 0.554421
C 4.190946 0.634426 -0.646332
C -1.743361 -4.077581 1.249607
C -1.608757 -4.241358 -0.147576
H 0.386469 1.319354 2.254465
H -2.307643 -0.181268 1.466575
H -2.375571 1.580574 1.877779
H -0.768406 3.142348 0.707358
H 0.343860 2.450832 -0.536922
H -4.245137 0.976072 0.401652
H -3.084870 0.336646 -0.851719
H -1.574508 1.895011 -1.988837
H -1.622358 3.661371 -1.526388
H 1.069311 -1.122232 2.413637
H -0.567829 -0.687887 2.901499
H -4.040299 2.015127 -2.471404
H -5.133179 2.629504 -1.152596
H -4.020970 3.764280 -1.979427
H 2.593621 1.911734 2.134397
H 3.217760 -0.655517 -2.130200
H -1.300623 -2.831897 2.967631
H -0.760471 -3.378845 -1.967112
H 5.173930 0.627564 -1.124612
H -2.273671 -4.828165 1.845085
H -2.026181 -5.117714 -0.653074


