%chk=000236969.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000236969

0 1
Cl 5.187380 -0.071193 0.207340
S 0.871685 -1.735025 -0.898120
N 1.207188 0.446116 0.450585
C -1.190604 -0.047196 -0.000507
C 0.244220 -0.296803 -0.052012
C 2.490403 -0.103772 0.193033
C -1.664554 1.276889 -0.040925
C -2.100646 -1.114643 0.089469
C 2.498149 -1.272489 -0.514920
C 3.646018 0.660786 0.736270
C -3.038138 1.525610 -0.004582
C -3.472590 -0.854701 0.126087
C -3.942776 0.461963 0.076543
H -0.953847 2.104185 -0.094868
H -1.746300 -2.144373 0.141529
H 3.345991 -1.863873 -0.823020
H 3.632246 0.668769 1.848480
H 3.629171 1.717294 0.388657
H -3.403889 2.551293 -0.037399
H -4.178062 -1.681865 0.195760
H -5.013843 0.658828 0.104000


%chk=000236969-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000236969

0 1
Cl 5.303360 0.000931 0.227394
S 0.889345 -2.113451 -0.313136
N 1.207001 0.476008 0.239276
C -1.199431 -0.118563 0.030522
C 0.238705 -0.405821 0.021107
C 2.487694 -0.084560 0.168112
C -1.633805 1.209713 0.308158
C -2.171943 -1.122407 -0.228941
C 2.533159 -1.439468 -0.113075
C 3.638796 0.855127 0.409931
C -3.007524 1.518995 0.324438
C -3.545763 -0.807046 -0.211495
C -3.970336 0.513935 0.065056
H -0.877880 1.975742 0.506541
H -1.857126 -2.150350 -0.445896
H 3.408507 -2.074720 -0.216656
H 3.619169 1.259729 1.433582
H 3.639323 1.681073 -0.317519
H -3.330595 2.543449 0.539411
H -4.285079 -1.589542 -0.413525
H -5.038375 0.757026 0.078114


