%chk=000262064.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000262064

0 1
Br 6.303232 -0.870125 0.864603
Cl -4.683878 2.818583 0.587290
S 0.553984 1.367129 -0.850860
O -0.377062 0.144839 -0.080044
O 0.247037 2.598267 -0.178249
O 0.327268 1.203561 -2.256237
C -1.681199 -2.301121 -0.454396
C -2.431030 -1.025926 -0.203542
C -1.535275 -3.121893 0.838009
C -1.750926 0.204439 -0.044960
C -3.828164 -1.016514 -0.108803
C -2.425973 1.405827 0.202794
C -0.803239 -4.437400 0.589123
C 2.099331 0.769946 -0.391566
C -4.532898 0.168295 0.130422
C -3.817436 1.356388 0.282773
C 2.788597 -0.102803 -1.241903
C 2.660112 1.156980 0.831117
C 4.044041 -0.594031 -0.872730
C 3.915200 0.671402 1.210508
C 4.590430 -0.200611 0.352293
H -2.194891 -2.900298 -1.232971
H -0.674660 -2.075024 -0.867377
H -0.990752 -2.522006 1.594745
H -2.534348 -3.321303 1.272255
H -4.378608 -1.951161 -0.227088
H -1.888831 2.351502 0.341846
H -0.701930 -5.013640 1.516118
H 0.206161 -4.270779 0.196227
H -1.335876 -5.068393 -0.131465
H -5.619714 0.161785 0.196184
H 2.351156 -0.399949 -2.203668
H 2.123026 1.846717 1.494543
H 4.583250 -1.273763 -1.535912
H 4.353665 0.973181 2.164221


%chk=000262064-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000262064

0 1
Br 6.535122 -0.038923 1.515219
Cl -4.561580 2.957647 1.465278
S 0.587954 0.767391 -1.197528
O -0.455114 -0.040740 0.362028
O 0.236635 2.353322 -1.279929
O 0.472440 -0.184262 -2.513265
C -2.014468 -2.260331 -0.669638
C -2.643299 -0.981028 -0.155662
C -1.493365 -3.173049 0.478552
C -1.829028 0.103930 0.315353
C -4.045867 -0.818928 -0.076182
C -2.405439 1.316349 0.795047
C -0.860337 -4.472616 -0.060360
C 2.276859 0.537870 -0.421126
C -4.637840 0.369086 0.414057
C -3.800918 1.423261 0.839977
C 2.983398 -0.638824 -0.716929
C 2.763849 1.552299 0.418968
C 4.261133 -0.807281 -0.138294
C 4.042074 1.378319 0.994708
C 4.768874 0.200118 0.712041
H -2.757553 -2.822231 -1.267329
H -1.167951 -2.021368 -1.340473
H -0.750570 -2.605262 1.069883
H -2.330169 -3.416777 1.162491
H -4.695944 -1.633141 -0.415421
H -1.749969 2.128527 1.119724
H -0.492817 -5.109198 0.765109
H -0.004067 -4.250809 -0.724900
H -1.591822 -5.064015 -0.643020
H -5.725589 0.476590 0.456220
H 2.562192 -1.391325 -1.390509
H 2.178204 2.457498 0.605843
H 4.845785 -1.706931 -0.347308
H 4.458988 2.146933 1.650676


