%chk=000239416.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000239416

0 1
Br -3.865887 2.579279 -0.000081
O 3.812241 -1.984296 0.000223
C 0.153325 0.056024 -0.000033
C -1.125904 -0.643762 -0.000001
C 0.175837 1.470397 -0.000040
C -2.338083 0.095460 0.000041
C 1.389006 -0.638867 -0.000034
C -1.070487 2.204789 -0.000053
C -2.253124 1.540190 -0.000023
C 2.599239 0.042043 -0.000055
C 1.418529 2.158140 -0.000031
C -1.186602 -2.062411 -0.000001
C 2.608209 1.458056 -0.000038
C -3.574644 -0.601494 0.000140
C -2.401049 -2.720388 0.000069
C -3.605606 -1.983087 0.000156
C 3.857728 -0.770803 -0.000085
C 5.170676 -0.043707 0.000126
H 1.394813 -1.737524 -0.000043
H -1.017060 3.295844 -0.000100
H 1.420405 3.247977 -0.000026
H -0.255892 -2.634835 -0.000061
H 3.555570 1.997091 -0.000024
H -4.514925 -0.046564 0.000213
H -2.439212 -3.809711 0.000051
H -4.557523 -2.513223 0.000240
H 5.289390 0.590735 0.888129
H 5.289220 0.591832 -0.887090
H 6.010007 -0.757887 -0.000371


%chk=000239416-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000239416

0 1
Br -3.909770 2.633850 -0.000270
O 3.866183 -2.026350 0.000018
C 0.158324 0.033286 0.000161
C -1.131647 -0.664966 0.000092
C 0.174693 1.475479 0.000102
C -2.367426 0.091472 -0.000040
C 1.405939 -0.646499 0.000281
C -1.066461 2.209507 -0.000027
C -2.272240 1.539219 -0.000094
C 2.634062 0.045972 0.000349
C 1.422911 2.172357 0.000171
C -1.218843 -2.089985 0.000150
C 2.633311 1.476455 0.000280
C -3.615533 -0.602525 -0.000109
C -2.453941 -2.750352 0.000082
C -3.662777 -2.001061 -0.000050
C 3.904494 -0.759569 0.000507
C 5.241086 -0.025430 -0.000195
H 1.466590 -1.739016 0.000347
H -1.035044 3.303105 -0.000070
H 1.414376 3.268234 0.000131
H -0.303194 -2.687844 0.000252
H 3.577757 2.029419 0.000331
H -4.542999 -0.022651 -0.000209
H -2.487463 -3.844889 0.000130
H -4.628622 -2.516813 -0.000104
H 5.339875 0.621563 0.891428
H 5.338793 0.622061 -0.891570
H 6.055760 -0.764731 -0.000874


