%chk=000216850.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000216850

0 1
Cl 0.266883 3.328151 -1.407768
S 2.725633 -0.180270 0.816975
P -2.234457 -0.953234 -1.081579
O -3.575713 -1.664231 -0.415416
O -2.476194 -0.322912 -2.399028
O 1.999085 -0.892976 -0.538822
O 3.757042 -1.068768 1.269951
O 1.615295 0.129182 1.691663
N -1.662456 0.148053 0.136027
N -1.146984 -2.352421 -1.108792
C -1.542684 -0.470935 1.488803
C -2.919813 -1.023766 1.889325
C -3.413050 -2.124620 0.950914
C -0.543092 1.046332 -0.253268
C 0.244064 -2.102838 -1.561790
C -1.102629 2.197289 -1.093107
C 1.154363 -2.042360 -0.317946
C 3.341658 1.237620 0.012924
C 4.289613 1.989593 0.931132
H -0.748752 -1.260474 1.537389
H -1.221083 0.311812 2.216962
H -3.657755 -0.190470 1.904781
H -2.876537 -1.407336 2.927345
H -4.449103 -2.437750 1.196080
H -2.754028 -3.014278 0.955539
H -0.062648 1.449175 0.676600
H 0.277087 0.531635 -0.810369
H -1.535835 -3.206244 -1.545198
H 0.377309 -1.163559 -2.154460
H 0.586918 -2.915179 -2.240032
H -1.896781 2.757373 -0.566632
H -1.502940 1.867199 -2.077212
H 0.569798 -1.909026 0.621329
H 1.812132 -2.924391 -0.231370
H 3.856963 0.978799 -0.940876
H 2.518767 1.916605 -0.322513
H 4.719439 2.863238 0.417556
H 3.785654 2.375308 1.829439
H 5.138131 1.368271 1.257444


%chk=000216850-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000216850

0 1
Cl -1.547215 4.163736 -0.423091
S 3.190364 -0.239458 1.002733
P -1.980844 -1.024690 -1.302984
O -3.440117 -1.847606 -0.806248
O -2.090723 -0.250762 -2.688179
O 2.684220 -1.641612 -0.175887
O 4.162893 -0.786946 2.170881
O 1.832204 0.564947 1.406374
N -1.579444 0.033564 0.011765
N -0.855975 -2.359752 -1.198285
C -1.874615 -0.400856 1.401414
C -3.311106 -0.957195 1.546598
C -3.552647 -2.182623 0.645678
C -1.087057 1.401848 -0.250069
C 0.592992 -2.116220 -1.363106
C -2.245674 2.412005 -0.237150
C 1.287258 -2.080630 0.017113
C 4.216759 0.739721 -0.312557
C 5.058834 1.804112 0.381217
H -1.145419 -1.171634 1.729428
H -1.732314 0.472923 2.060997
H -4.044740 -0.167994 1.297809
H -3.479618 -1.260884 2.598760
H -4.580219 -2.568201 0.744538
H -2.831155 -2.990134 0.885890
H -0.323878 1.656300 0.507896
H -0.604333 1.432158 -1.242201
H -1.213764 -3.271258 -1.492711
H 0.773439 -1.153271 -1.878215
H 1.033878 -2.904524 -1.997668
H -2.797439 2.417619 0.715513
H -2.923022 2.263065 -1.090477
H 0.752148 -1.350559 0.655147
H 1.288531 -3.072311 0.504557
H 4.798870 -0.058003 -0.799689
H 3.435109 1.124707 -0.984981
H 5.663734 2.324443 -0.384463
H 4.434114 2.557385 0.890121
H 5.749268 1.356187 1.115533


