%chk=000284311.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000284311

0 1
Br 6.541991 0.844030 0.472359
S 0.219899 0.696674 -0.715721
S -3.919105 1.230461 -0.027053
O -2.410280 0.605679 0.405694
O -4.890983 0.597845 0.823613
O -4.025785 1.080987 -1.454896
C -1.995838 -0.659013 -0.150508
C -0.498488 -0.719652 0.192239
C -2.753545 -1.806552 0.531955
C 0.102535 -2.045809 -0.261197
C -2.155194 -3.153090 0.109746
C -0.647255 -3.217901 0.392639
C 1.938790 0.659357 -0.343249
C -3.634875 2.873815 0.439212
C 2.429289 0.285555 0.909839
C 2.800253 1.091942 -1.358174
C 3.806036 0.336927 1.154893
C 4.175434 1.153313 -1.114173
C 4.661051 0.771131 0.139532
H -2.182979 -0.642639 -1.251701
H -0.359083 -0.565837 1.288002
H -3.833426 -1.765822 0.283379
H -2.710891 -1.685547 1.632903
H 1.178931 -2.095289 -0.003742
H 0.056093 -2.140636 -1.365835
H -2.344104 -3.326502 -0.968243
H -2.673855 -3.973155 0.642823
H -0.470630 -3.215066 1.485636
H -0.236202 -4.175710 0.020743
H -3.766831 3.591770 -0.386424
H -4.288614 3.219006 1.255841
H -2.601603 3.039233 0.800056
H 1.756349 -0.037341 1.704087
H 2.411282 1.378668 -2.337256
H 4.197952 0.044963 2.130126
H 4.854681 1.491905 -1.898042


%chk=000284311-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000284311

0 1
Br 5.155422 2.712510 1.967647
S 0.250325 0.005815 -1.555630
S -2.944007 1.553610 0.591943
O -1.675120 0.189646 0.977552
O -3.673163 1.956734 1.972188
O -3.805649 1.082155 -0.700591
C -1.831391 -1.020528 0.142865
C -0.450914 -1.390823 -0.443353
C -2.406561 -2.170156 0.997207
C -0.552354 -2.686969 -1.281952
C -2.512697 -3.468734 0.160820
C -1.141456 -3.849030 -0.442733
C 1.595215 0.716562 -0.518271
C -1.701715 2.893266 0.080724
C 1.463818 0.907434 0.879108
C 2.781984 1.122933 -1.177080
C 2.520295 1.487743 1.617872
C 3.832847 1.724233 -0.448047
C 3.690893 1.894331 0.944879
H -2.530907 -0.795887 -0.692518
H 0.284369 -1.519589 0.371319
H -3.396802 -1.869328 1.384910
H -1.746401 -2.335036 1.871109
H 0.450436 -2.948502 -1.664932
H -1.198832 -2.502687 -2.163654
H -3.248526 -3.323391 -0.656185
H -2.896871 -4.289765 0.794418
H -0.436983 -4.107173 0.374034
H -1.236357 -4.748138 -1.080365
H -2.297010 3.762216 -0.233408
H -1.092213 3.092861 0.971684
H -1.117126 2.440670 -0.733214
H 0.535646 0.621973 1.385846
H 2.894456 0.962733 -2.254338
H 2.420667 1.628330 2.698167
H 4.747681 2.037678 -0.958917


