%chk=000076158.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000076158

0 1
 Br   2.045800       2.818900     -9.9999997E-05
 Br   1.832000      -2.921400     -3.0000001E-04
 O    3.091700     -9.4200000E-02 -1.9999999E-04
 O   -3.124500       1.202500      1.9999999E-04
 C   -1.060600      6.0500000E-02   0.000000    
 C  -0.4086000      -1.172600      1.9999999E-04
 C  -0.3186000       1.241700     -1.9999999E-04
 C    1.075300       1.189800      9.9999997E-05
 C   0.9853000      -1.224500      3.9999999E-04
 C    1.727200     -4.3299999E-02  3.9999999E-04
 C   -2.513900      0.1150000     -1.9999999E-04
 C   -3.331300      -1.172300     -9.9999997E-05
 H  -0.9643000      -2.105900      9.9999997E-05
 H  -0.8212000       2.206300     -3.9999999E-04
 H   -3.123200      -1.752600      0.9026000    
 H   -3.122700      -1.753100     -0.9022000    
 H   -4.396400     -0.9194000     -6.0000003E-04
 H    3.434000      0.8164000     -3.9999999E-04


%chk=000076158-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000076158

0 1
Br 2.104075 2.869127 -0.000496
Br 1.952302 -2.934564 0.000116
O 3.150941 -0.112260 -0.000412
O -3.154501 1.260051 -0.000145
C -1.083151 0.039211 0.000423
C -0.390127 -1.200596 0.000380
C -0.340967 1.250743 0.000148
C 1.054444 1.204231 -0.000117
C 1.012961 -1.229082 0.000135
C 1.771951 -0.027399 -0.000119
C -2.583849 0.129998 0.000750
C -3.398096 -1.158207 -0.000227
H -0.939518 -2.145550 0.000564
H -0.892072 2.195961 0.000179
H -3.173886 -1.772431 0.891819
H -3.172253 -1.772282 -0.891961
H -4.468423 -0.903428 -0.001162
H 3.556170 0.798277 -0.000575


