%chk=000183381.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000183381

0 1
Cl -3.928534 -0.460211 2.323392
S -1.616822 -0.816463 0.416709
N 1.232066 0.668862 -1.027663
N 2.215369 -0.077318 1.114221
N 1.720798 -1.680362 -0.516604
N -3.082641 1.326097 0.530759
N 2.462367 -2.194225 -2.889950
C 1.427370 2.075359 -0.549745
C 1.214958 2.235704 0.963070
C -0.106449 0.388561 -1.623014
C 2.108095 1.250811 1.735195
C 1.727775 -0.294861 -0.070873
C -1.239962 0.492299 -0.669638
C -2.113105 1.528852 -0.469925
C -2.954841 0.141068 1.089463
C 2.174870 -1.936521 -1.796342
H 0.761037 2.761013 -1.112447
H 2.474288 2.349664 -0.823168
H 0.149785 2.065651 1.218835
H 1.432844 3.275171 1.270500
H -0.079218 -0.623266 -2.101695
H -0.243671 1.103374 -2.473970
H 3.143533 1.652906 1.840280
H 1.721840 1.098411 2.770505
H 2.093772 -2.337331 0.196997
H -2.137323 2.476855 -1.000891


%chk=000183381-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000183381

0 1
Cl -4.317140 -0.165323 2.240326
S -1.690918 -0.705119 0.640566
N 1.185043 0.683989 -0.817587
N 2.567634 -0.037058 1.052561
N 1.970899 -1.590782 -0.567125
N -3.376766 1.307867 0.124879
N 2.007291 -2.253283 -3.031598
C 1.336006 2.095386 -0.363424
C 1.309237 2.173036 1.180540
C -0.064520 0.335084 -1.547576
C 2.431458 1.267373 1.742132
C 1.908278 -0.245656 -0.057308
C -1.317483 0.455742 -0.711385
C -2.323037 1.407103 -0.796761
C -3.201086 0.287783 0.927075
C 2.012499 -1.932212 -1.874254
H 0.518659 2.688981 -0.805470
H 2.293977 2.493375 -0.749644
H 0.321275 1.829738 1.539212
H 1.448526 3.215994 1.518272
H 0.027700 -0.677032 -1.972404
H -0.160492 1.022518 -2.408077
H 3.410284 1.782514 1.670549
H 2.267395 1.063695 2.816423
H 2.344172 -2.246226 0.126654
H -2.350691 2.212614 -1.532574


