%chk=000279003.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000279003

0 1
Br 0.674879 3.264887 0.555868
S -0.334287 0.976010 -1.882285
O 0.796131 -1.622598 -1.303363
O 2.693914 1.741350 2.215728
O -6.241495 0.335753 1.121881
O -5.773129 -1.756351 0.833468
N -5.516032 -0.567686 0.740126
C 2.797221 -0.938359 -0.204227
C 3.298243 -0.027906 0.746622
C 0.879522 0.651963 -0.645651
C 1.432098 -0.741046 -0.777928
C 2.476937 1.137464 1.195983
C 1.333871 1.515169 0.263809
C 3.567027 -2.033615 -0.598704
C 4.567431 -0.221756 1.296136
C -1.825632 0.507568 -1.047716
C 4.847113 -2.217711 -0.053381
C 5.343995 -1.317212 0.888195
C -2.670815 1.518120 -0.584347
C -2.152561 -0.845064 -0.935051
C -4.223602 -0.191857 0.115388
C -3.888752 1.166115 0.003114
C -3.367268 -1.203284 -0.346162
H 3.166190 -2.744244 -1.327799
H 4.947617 0.479397 2.045567
H 5.449558 -3.071899 -0.367493
H 6.337742 -1.462388 1.315633
H -2.388247 2.570733 -0.672528
H -1.462335 -1.617532 -1.302507
H -4.577543 1.932137 0.376335
H -3.655891 -2.255356 -0.243212


%chk=000279003-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000279003

0 1
Br 1.828688 3.985319 -1.092558
S -0.469056 1.684700 -1.864985
O 0.412399 -1.145947 -1.069492
O 4.129589 2.620060 0.392632
O -5.232998 -1.493355 1.834171
O -5.892174 -2.101288 -0.264460
N -5.095760 -1.491647 0.549432
C 2.436882 -0.654074 0.142663
C 3.413314 0.315770 0.496192
C 1.010641 1.192545 -0.925771
C 1.223025 -0.273950 -0.637647
C 3.255811 1.750181 0.103445
C 1.995951 2.112428 -0.623356
C 2.616700 -2.007117 0.519658
C 4.563597 -0.073918 1.222893
C -1.797038 0.653599 -1.105428
C 3.762272 -2.389712 1.248250
C 4.736107 -1.422338 1.600254
C -1.998127 0.657571 0.295372
C -2.682399 -0.032675 -1.967935
C -3.952640 -0.743426 -0.025944
C -3.077039 -0.058048 0.845869
C -3.775493 -0.735813 -1.427007
H 1.853594 -2.736144 0.230252
H 5.303279 0.691316 1.477732
H 3.899860 -3.435850 1.540234
H 5.625390 -1.721853 2.164359
H -1.323402 1.220063 0.948296
H -2.503500 -0.037957 -3.046847
H -3.259891 -0.083149 1.923118
H -4.475682 -1.284488 -2.061895


