%chk=000184226.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000184226

0 1
Br -4.636955 2.065414 0.640185
Br 3.732919 2.650478 0.341337
O -1.086373 -2.570948 0.344079
O 3.308794 -0.368507 0.779829
O -3.220643 -2.069128 -0.214404
O 4.315703 -0.096509 -1.247734
N -1.577990 1.927744 -0.460406
C -0.238818 1.551221 -0.184209
C -0.223647 0.126996 0.019338
C -2.376407 0.789435 -0.424848
C -1.574386 -0.333802 -0.134649
C 0.990640 -0.523217 0.300785
C 0.929178 2.332321 -0.096863
C -1.992986 3.302846 -0.761293
C -3.835805 0.813566 -0.631660
C 2.128463 0.261661 0.383611
C -2.077619 -1.690501 -0.025553
C 2.110027 1.672448 0.190534
C -1.449274 -3.984945 0.461282
C -1.492361 -4.615831 -0.914606
C 4.401498 -0.436743 -0.101235
C 5.538513 -1.007196 0.666126
H 1.016736 -1.605144 0.454222
H 0.896713 3.410447 -0.246273
H -2.876939 3.325969 -1.423633
H -2.244983 3.848939 0.169640
H -1.181279 3.851020 -1.274266
H -4.283187 -0.202161 -0.449055
H -4.131706 1.117959 -1.653330
H -0.619317 -4.357161 1.088835
H -2.413647 -4.060028 0.995173
H -1.596452 -5.705102 -0.854750
H -2.343193 -4.232958 -1.498469
H -0.582739 -4.394841 -1.488053
H 6.324272 -0.247186 0.811885
H 5.992739 -1.853202 0.126814
H 5.237412 -1.361651 1.666914


%chk=000184226-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000184226

0 1
Br -4.928536 1.599426 0.830876
Br 3.712459 2.908549 0.397122
O -1.060931 -2.527512 0.379598
O 3.385732 -0.154100 0.906258
O -3.228508 -2.046912 -0.347330
O 3.937603 -0.802744 -1.284312
N -1.585747 1.997160 -0.479641
C -0.265054 1.641049 -0.169759
C -0.221533 0.221417 0.049091
C -2.380613 0.843806 -0.476861
C -1.570204 -0.272394 -0.148629
C 1.014514 -0.383045 0.383631
C 0.878359 2.462859 -0.074640
C -2.030438 3.367705 -0.758736
C -3.826764 0.866391 -0.773244
C 2.153943 0.427295 0.486402
C -2.062139 -1.652779 -0.066568
C 2.089353 1.833205 0.256655
C -1.441070 -3.971251 0.476860
C -1.226870 -4.679652 -0.863716
C 4.237983 -0.739772 -0.081127
C 5.498261 -1.230744 0.589103
H 1.080852 -1.456816 0.565652
H 0.842354 3.540187 -0.254286
H -3.118093 3.445933 -0.612448
H -1.548919 4.064021 -0.051334
H -1.773819 3.669631 -1.790798
H -4.211824 -0.152410 -0.905861
H -4.116271 1.538159 -1.593511
H -0.774755 -4.360900 1.263354
H -2.493809 -4.035054 0.802196
H -1.426839 -5.761334 -0.749004
H -1.913328 -4.282848 -1.630130
H -0.187943 -4.555675 -1.215076
H 6.056090 -0.371655 1.001541
H 6.124846 -1.763303 -0.140245
H 5.248556 -1.894190 1.434216


