%chk=000213365.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000213365

0 1
Cl -4.888524 4.731638 -0.047626
S -2.396651 -3.347381 -0.384641
O 4.365602 -0.918054 -0.431075
O -5.623269 -1.721014 0.894724
O 3.805788 1.860671 0.133001
N 0.701584 -1.102598 -0.567289
N -3.510339 -1.046185 0.245053
C -2.143571 -1.524380 -0.103516
C -1.155560 -1.358901 1.053530
C -1.623215 -0.927442 -1.409506
C 0.252483 -1.831374 0.665193
C -0.199819 -1.411567 -1.726055
C 2.125526 -1.424202 -0.893232
C -3.980151 -3.431067 0.474659
C -4.494871 -2.019486 0.573489
C 3.015029 -0.442290 -0.111592
C -3.841881 0.359295 0.188595
C 2.852491 1.011440 -0.563808
C -5.101139 0.755774 -0.307140
C -2.918227 1.327997 0.622514
C 5.366464 -0.008667 -0.131460
C 5.096114 1.354879 0.127057
C -5.426520 2.109477 -0.374315
C -3.240845 2.683554 0.547559
C -4.489735 3.057466 0.047794
C 6.677773 -0.489433 -0.115753
C 6.133829 2.240600 0.425593
C 7.713481 0.405507 0.175480
C 7.444443 1.750735 0.450335
H -1.498369 -1.896505 1.959219
H -1.111244 -0.280676 1.346803
H -1.618603 0.184051 -1.338005
H -2.299588 -1.163111 -2.256785
H 0.958595 -1.587251 1.490019
H 0.272412 -2.938108 0.548018
H -0.205398 -2.490142 -1.998384
H 0.178251 -0.859207 -2.615743
H 2.428182 -2.467168 -0.649246
H 2.320573 -1.308751 -1.982595
H -3.877480 -3.891659 1.478687
H -4.693512 -4.070754 -0.087596
H 2.901465 -0.536616 0.990296
H 3.011309 1.140711 -1.647752
H 1.878471 1.440665 -0.262466
H -5.835159 0.006329 -0.616056
H -1.945458 1.029119 1.028551
H -6.401470 2.423659 -0.750754
H -2.528073 3.439044 0.880897
H 6.873011 -1.538744 -0.324455
H 5.911422 3.285607 0.630610
H 8.740834 0.044970 0.191183
H 8.263242 2.429940 0.682683


%chk=000213365-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000213365

0 1
Cl -4.669428 4.902835 0.298885
S -2.370795 -3.522026 0.139695
O 4.406778 -0.959802 -0.475150
O -5.795083 -1.561872 0.785736
O 3.810595 1.903416 -0.343581
N 0.676085 -1.205421 -0.619383
N -3.547164 -1.066655 0.300974
C -2.179476 -1.588167 0.023900
C -1.146834 -1.123499 1.076057
C -1.687387 -1.218168 -1.394231
C 0.265737 -1.640274 0.740607
C -0.257119 -1.735333 -1.645783
C 2.098459 -1.502382 -0.914608
C -4.206208 -3.407565 0.525619
C -4.613620 -1.934787 0.554303
C 3.025653 -0.438446 -0.307278
C -3.794580 0.362715 0.295965
C 2.910135 0.927062 -0.993391
C -4.224205 1.001476 -0.890743
C -3.658576 1.108929 1.489680
C 5.410261 0.007900 -0.223853
C 5.117161 1.398329 -0.143892
C -4.492428 2.387202 -0.897055
C -3.922133 2.495609 1.497179
C -4.329923 3.113462 0.298882
C 6.733383 -0.444312 -0.044961
C 6.144753 2.318963 0.145065
C 7.762901 0.481277 0.231312
C 7.466464 1.862455 0.337121
H -1.450556 -1.477145 2.077311
H -1.121754 -0.016686 1.081428
H -1.680285 -0.114839 -1.487673
H -2.378566 -1.634190 -2.148781
H 0.979867 -1.240283 1.482128
H 0.286471 -2.756374 0.832232
H -0.267851 -2.855006 -1.659702
H 0.082246 -1.395301 -2.641042
H 2.421315 -2.501919 -0.538922
H 2.243876 -1.509509 -2.011095
H -4.417541 -3.861538 1.506638
H -4.790765 -3.930397 -0.247706
H 2.837281 -0.311590 0.778218
H 3.179313 0.838001 -2.065398
H 1.892706 1.331385 -0.888017
H -4.365591 0.412758 -1.802612
H -3.365793 0.602921 2.414910
H -4.828176 2.888075 -1.809304
H -3.821452 3.079323 2.416320
H 6.932169 -1.518410 -0.116575
H 5.889814 3.381774 0.204891
H 8.788636 0.124429 0.370083
H 8.260935 2.581998 0.560295


