%chk=000215028.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000215028

0 1
Cl -5.298868 -1.784114 -1.041844
S 0.318036 -1.203611 1.584986
N -0.090365 1.423955 -0.296775
N 0.121391 4.194246 0.547280
C -0.540511 0.296984 -1.186235
C 0.738196 2.413066 -1.068092
C -1.259510 2.139724 0.319948
C 0.651435 -0.570496 -1.669181
C -1.518519 -0.609747 -0.462806
C 1.270741 3.487161 -0.098103
C -0.735641 3.218332 1.289570
C 1.835213 -0.621185 -0.750026
C -1.170298 -1.343275 0.674755
C 1.748014 -0.879468 0.619139
C -2.811659 -0.753653 -0.997999
C 3.113166 -0.412477 -1.312051
C -2.086912 -2.222733 1.276800
C -3.712036 -1.619407 -0.382473
C 2.902070 -0.914229 1.422958
C -3.370786 -2.363150 0.751808
C 4.259871 -0.454098 -0.523615
C 4.154413 -0.702158 0.851759
H -1.045637 0.699856 -2.110334
H 0.168973 2.901330 -1.888972
H 1.600540 1.882564 -1.523771
H -1.867361 1.408538 0.895224
H -1.924740 2.607481 -0.437731
H 0.963137 -0.205165 -2.670524
H 0.295927 -1.610736 -1.850522
H 1.955693 3.008898 0.637119
H 1.859035 4.239460 -0.665348
H -1.594695 3.777203 1.718541
H -0.201509 2.724142 2.131604
H 0.482403 4.894688 1.205326
H -3.110094 -0.191496 -1.883250
H 3.204593 -0.217041 -2.379289
H -1.801676 -2.804960 2.157489
H 2.828763 -1.108527 2.495353
H -4.091238 -3.039595 1.210939
H 5.238080 -0.293583 -0.972979
H 5.048668 -0.730823 1.471125


%chk=000215028-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000215028

0 1
Cl -5.355317 -1.903964 -1.164792
S 0.356712 -1.141484 1.735378
N -0.144651 1.497022 -0.288777
N 0.021075 4.265106 0.501477
C -0.543674 0.339100 -1.132249
C 0.719437 2.461564 -1.022860
C -1.309516 2.204110 0.311836
C 0.691210 -0.465390 -1.659012
C -1.514607 -0.599434 -0.418183
C 1.195978 3.582081 -0.081605
C -0.828361 3.317676 1.256563
C 1.888742 -0.617955 -0.728817
C -1.177466 -1.331694 0.751349
C 1.835268 -0.928471 0.656057
C -2.794548 -0.802691 -0.992159
C 3.179210 -0.476278 -1.312747
C -2.117248 -2.220163 1.333331
C -3.714376 -1.683602 -0.397398
C 3.031654 -1.078452 1.408020
C -3.398628 -2.399147 0.771303
C 4.370685 -0.628653 -0.576639
C 4.293527 -0.929442 0.801994
H -1.084170 0.699648 -2.048818
H 0.166823 2.921334 -1.882124
H 1.604566 1.934171 -1.415985
H -1.913815 1.480283 0.884589
H -1.960381 2.657028 -0.478280
H 1.051951 0.010830 -2.589191
H 0.318720 -1.464044 -1.960815
H 1.857819 3.121130 0.691870
H 1.791998 4.312263 -0.659657
H -1.704902 3.857521 1.659368
H -0.287885 2.835149 2.107472
H 0.277843 5.094307 1.052154
H -3.068616 -0.254295 -1.899217
H 3.235609 -0.240155 -2.383164
H -1.839886 -2.786627 2.228526
H 2.968981 -1.322739 2.474952
H -4.117838 -3.087009 1.224327
H 5.342081 -0.513839 -1.068993
H 5.202304 -1.052894 1.400720


