%chk=000247224.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000247224

0 1
Br -0.001161 -2.756654 0.008600
N -2.416370 -0.836374 -0.080914
N 2.415826 -0.837795 0.085469
N -1.215394 1.220213 -0.045997
N 1.216470 1.219501 0.037936
N -3.674352 -0.185275 -0.125757
N 3.674262 -0.187380 0.127267
C -1.213099 -0.170947 -0.041317
C 1.213016 -0.171777 0.042307
C -0.000316 -0.894783 0.002888
C 0.000857 1.829439 -0.006096
H -2.497159 -1.857006 -0.079300
H 2.495746 -1.858477 0.092871
H 0.001201 2.934188 -0.009646
H -3.720705 0.433639 -0.950615
H -3.776008 0.440266 0.689075
H 3.719850 0.438416 0.946964
H 3.777737 0.431203 -0.692636


%chk=000247224-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000247224

0 1
Br -0.001123 -2.892726 0.009176
N -2.457280 -0.818712 -0.082581
N 2.456718 -0.820152 0.087402
N -1.218086 1.184734 -0.045755
N 1.219140 1.184012 0.037476
N -3.689014 -0.111875 -0.126624
N 3.688974 -0.114018 0.128031
C -1.222901 -0.199050 -0.041662
C 1.222836 -0.199782 0.042403
C -0.000325 -0.917528 0.002714
C 0.000774 1.780854 -0.006038
H -2.526418 -1.835776 -0.082345
H 2.524995 -1.837245 0.095198
H 0.001221 2.875661 -0.009728
H -3.729597 0.477847 -0.971449
H -3.788543 0.480341 0.711572
H 3.728444 0.482563 0.968086
H 3.790587 0.471249 -0.714779


