%chk=000230024.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000230024

0 1
Br 3.543149 2.720849 2.337469
O 0.004380 -3.669736 1.547808
O -0.668404 -3.629939 -0.584604
O -4.249439 1.902155 -0.001485
C 1.299103 -1.238835 -0.561227
C 0.199439 -1.566845 0.489627
C 2.528273 -2.156317 -0.388016
C 1.682127 0.222519 -0.447488
C -1.011883 -0.680680 0.319264
C -0.216561 -3.019586 0.354794
C 3.575222 -1.910385 -1.469795
C 2.331334 0.709100 0.698929
C 1.381220 1.103858 -1.497910
C -1.241462 0.355818 1.245482
C -1.893029 -0.857633 -0.755002
C 2.662106 2.061711 0.768359
C 1.723707 2.455510 -1.406473
C -2.335163 1.199440 1.104787
C -3.001965 -0.022995 -0.917729
C -3.211283 0.998769 0.016286
C 2.369834 2.949212 -0.267961
C -5.227634 1.789724 -1.063398
H 0.866084 -1.430510 -1.578741
H 0.629555 -1.422603 1.519520
H 2.210125 -3.218184 -0.422393
H 2.980534 -2.011059 0.612862
H 3.944666 -0.876890 -1.449029
H 3.175577 -2.095243 -2.473683
H 4.441832 -2.568751 -1.336639
H 2.576326 0.033920 1.518938
H 0.870705 0.736986 -2.387872
H -0.552682 0.504673 2.078835
H -1.722408 -1.667091 -1.472074
H 1.483657 3.133190 -2.225797
H -2.530000 2.006578 1.807732
H -3.676689 -0.179221 -1.752357
H 2.633815 4.004013 -0.197915
H -0.272045 -4.624721 1.527452
H -5.737332 0.823434 -1.010303
H -4.753412 1.949775 -2.035672
H -5.915480 2.610691 -0.821182


%chk=000230024-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000230024

0 1
Br 3.730433 2.747765 2.321304
O -0.205221 -3.648416 1.677245
O -0.468919 -3.666839 -0.626539
O -4.358551 1.901555 0.020545
C 1.333847 -1.239540 -0.559520
C 0.231546 -1.573748 0.514482
C 2.565162 -2.180529 -0.421854
C 1.718301 0.238049 -0.468585
C -1.019537 -0.695581 0.365064
C -0.173890 -3.038919 0.416688
C 3.629204 -1.955207 -1.516739
C 2.421470 0.729033 0.663861
C 1.374303 1.145876 -1.499270
C -1.301720 0.310562 1.324779
C -1.892746 -0.837825 -0.739595
C 2.756768 2.093000 0.738019
C 1.720822 2.512259 -1.408146
C -2.414815 1.157804 1.183348
C -3.017298 0.002857 -0.896235
C -3.277468 1.007518 0.069067
C 2.419740 3.005062 -0.282469
C -5.282235 1.785220 -1.109859
H 0.879275 -1.421611 -1.553282
H 0.656641 -1.417754 1.521878
H 2.216801 -3.229956 -0.472269
H 3.025744 -2.048626 0.577974
H 4.047324 -0.933828 -1.471835
H 3.195487 -2.100008 -2.524047
H 4.464838 -2.669538 -1.404066
H 2.708943 0.052658 1.475479
H 0.824566 0.780005 -2.373813
H -0.638610 0.438528 2.188283
H -1.705432 -1.625244 -1.478909
H 1.446514 3.203890 -2.211958
H -2.635127 1.938630 1.917255
H -3.676036 -0.137814 -1.758560
H 2.690399 4.061626 -0.204162
H -0.519602 -4.589048 1.578723
H -5.776867 0.794415 -1.126548
H -4.763972 1.956866 -2.073575
H -6.034181 2.571553 -0.948757


