%chk=000208333.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000208333

0 1
Br -3.734351 -2.717831 0.095832
O -0.531494 2.291177 -0.003200
O -4.650345 0.246141 0.057292
O 4.997596 -0.086148 0.302834
N -0.583262 -0.022678 0.052400
N -2.617901 1.282189 0.018236
C -1.322100 -1.216854 0.071467
C 0.873954 -0.041263 0.075103
C -1.209342 1.286296 0.019527
C -2.691479 -1.148575 0.070045
C -3.450811 0.095089 0.049696
C -0.593581 -2.513758 0.090294
C 1.582450 0.025199 -1.131542
C 1.541231 -0.096826 1.316195
C -3.284620 2.613366 -0.031689
C 2.979224 0.010651 -1.114044
C 2.927252 -0.113133 1.343435
C 3.637663 -0.057094 0.121448
C 5.844279 0.019819 -0.869064
H 0.503131 -2.431405 0.075917
H -0.876822 -3.137848 -0.777628
H -0.857658 -3.101453 0.989028
H 1.049639 0.095058 -2.081405
H 0.969744 -0.120345 2.245618
H -3.336952 2.978005 -1.071312
H -2.728141 3.350437 0.573240
H -4.315870 2.527431 0.361631
H 3.529584 0.065025 -2.048487
H 3.480831 -0.153928 2.280727
H 6.846853 -0.007977 -0.420459
H 5.670995 0.972104 -1.378928
H 5.686904 -0.836570 -1.530407


%chk=000208333-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000208333

0 1
Br -3.828578 -2.753648 0.109836
O -0.515783 2.308847 -0.007302
O -4.726213 0.248895 0.027081
O 5.060205 -0.035190 0.306381
N -0.605844 -0.041026 0.057550
N -2.612245 1.273607 0.009635
C -1.358722 -1.232238 0.079489
C 0.852839 -0.053430 0.089507
C -1.206804 1.255672 0.017788
C -2.740291 -1.147844 0.072515
C -3.470574 0.120056 0.036981
C -0.627343 -2.553731 0.108069
C 1.582958 0.004134 -1.113287
C 1.528018 -0.090658 1.332132
C -3.243193 2.613538 -0.029592
C 2.994460 0.010218 -1.090275
C 2.932212 -0.086947 1.367722
C 3.670124 -0.036965 0.156127
C 5.878696 0.050080 -0.907949
H 0.461526 -2.426491 0.038880
H -0.968192 -3.192122 -0.725836
H -0.862451 -3.099751 1.039553
H 1.049877 0.056181 -2.068297
H 0.953029 -0.112152 2.263689
H -2.921159 3.154041 -0.934700
H -2.936216 3.199626 0.852014
H -4.331786 2.461574 -0.035037
H 3.546354 0.059747 -2.032924
H 3.479020 -0.111907 2.314559
H 6.918604 0.050076 -0.551242
H 5.674047 0.985093 -1.463800
H 5.710028 -0.822986 -1.567465


