%chk=000211599.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000211599

0 1
Br 6.245955 -0.667084 1.138808
Cl -1.430030 -2.849534 0.640100
Cl -4.998614 2.172446 -0.078941
S 0.398832 0.820249 -0.990701
O -0.474763 -0.227166 0.076754
O 0.018722 2.155021 -0.623765
O 0.157086 0.311586 -2.305417
C 1.967329 0.424212 -0.424211
C -1.834867 -0.229396 0.135834
C 2.633975 -0.693033 -0.942461
C 2.571493 1.214484 0.561991
C 3.911524 -1.022224 -0.480191
C 3.848488 0.894221 1.030231
C -2.427704 -1.474817 0.440164
C -2.622634 0.917587 -0.024373
C 4.502416 -0.223217 0.502511
C -4.004302 0.777466 0.115944
C -3.811400 -1.578983 0.580702
C -4.613321 -0.444531 0.413186
H 2.161455 -1.312599 -1.715464
H 2.048776 2.090457 0.967686
H 4.432112 -1.893552 -0.884103
H 4.320915 1.510569 1.798450
H -2.174960 1.896793 -0.234547
H -4.265146 -2.543791 0.816604
H -5.695938 -0.515361 0.514310


%chk=000211599-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000211599

0 1
Br 6.361555 -0.976931 0.915271
Cl -0.954840 -2.531858 0.295342
Cl -5.656932 1.846962 0.421818
S 0.382059 1.052624 -0.937480
O -0.644672 0.488797 0.756697
O 0.382381 2.672630 -1.026255
O -0.177901 0.143229 -2.160656
C 2.076149 0.467904 -0.397654
C -1.934253 0.086813 0.526725
C 2.411070 -0.878869 -0.612353
C 2.935956 1.408498 0.192116
C 3.699114 -1.306437 -0.222037
C 4.221417 0.971919 0.582713
C -2.267463 -1.288191 0.321075
C -2.989748 1.049128 0.543969
C 4.583002 -0.377406 0.372180
C -4.313555 0.621573 0.384448
C -3.603383 -1.699430 0.168283
C -4.641120 -0.740313 0.196329
H 1.700523 -1.571205 -1.074012
H 2.623362 2.448189 0.328598
H 4.002813 -2.345193 -0.375507
H 4.923472 1.672606 1.041955
H -2.732092 2.101482 0.692237
H -3.839192 -2.757160 0.023017
H -5.682328 -1.049559 0.072281


