%chk=000260050.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000260050

0 1
Br 5.747957 -2.238579 -0.979618
S -0.870304 3.048836 0.906696
O -4.790775 0.103551 0.477739
O -2.915175 -1.205096 0.699712
N -0.500665 0.556754 0.212476
N -2.840162 1.166976 0.593846
C 1.954920 0.366566 -0.036477
C 0.772987 1.184846 0.272794
C 3.134050 0.976902 -0.498969
C 1.911429 -1.029744 0.129473
C -1.469066 1.397877 0.521928
C 0.754510 2.510646 0.618253
C 4.263410 0.204191 -0.780899
C 3.037889 -1.806993 -0.150016
C 4.201236 -1.178970 -0.599479
C -5.654697 -1.083766 0.442681
C -3.430445 -0.126203 0.587201
C -5.534973 -1.775649 -0.895874
H 3.172356 2.055715 -0.648853
H 0.986949 -1.508071 0.472232
H 1.589538 3.180871 0.725771
H 5.176196 0.681642 -1.139214
H 2.999281 -2.889612 -0.018297
H -3.471419 1.977757 0.565517
H -5.381770 -1.736356 1.291006
H -6.639569 -0.607190 0.607764
H -6.277077 -2.576546 -1.002353
H -5.676665 -1.076842 -1.730829
H -4.540547 -2.233413 -1.023911


%chk=000260050-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000260050

0 1
Br 5.893607 -2.325959 -0.674062
S -0.954414 3.203106 0.454927
O -4.750140 -0.003312 0.632324
O -2.787389 -1.289988 0.361272
N -0.443719 0.579767 0.195684
N -2.796994 1.093683 0.477912
C 2.019310 0.424859 -0.065116
C 0.802690 1.242133 0.121961
C 3.313755 1.003680 -0.154836
C 1.895933 -0.988214 -0.158614
C -1.445367 1.405424 0.363085
C 0.732666 2.625677 0.236916
C 4.457417 0.199555 -0.333780
C 3.031894 -1.805053 -0.337581
C 4.302561 -1.200403 -0.423736
C -5.573437 -1.249280 0.619330
C -3.364776 -0.192603 0.472479
C -5.913299 -1.666906 -0.813486
H 3.444757 2.089095 -0.086292
H 0.897732 -1.430730 -0.087877
H 1.535363 3.358299 0.211270
H 5.449827 0.654050 -0.401941
H 2.925743 -2.891256 -0.407792
H -3.466803 1.857570 0.588741
H -5.014244 -2.041600 1.147494
H -6.469494 -0.969267 1.195612
H -6.590875 -2.540666 -0.794214
H -6.420867 -0.849404 -1.353984
H -5.002038 -1.952159 -1.365395


