%chk=000244276.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000244276

0 1
Br -5.261141 -2.215583 -2.341519
Br 0.034439 -1.009203 0.153736
O -3.312549 0.284558 1.157610
O 3.868207 0.214408 0.889469
N -1.356380 0.650435 -0.028683
N 2.587168 -0.015321 -0.976709
C 0.945607 2.587112 -0.480772
C 0.474809 2.114386 0.901893
C 2.472017 2.493080 -0.614717
C -1.005114 1.729595 0.972998
C 2.957699 1.326943 -1.493001
C -2.708533 0.125362 0.123858
C 3.096130 -0.474447 0.234157
C -3.207328 -0.667033 -1.065838
C 2.714118 -1.874392 0.690946
C -4.582591 -1.244149 -0.774754
C 1.399865 -2.421678 0.170042
H 0.466062 1.990924 -1.280779
H 0.617970 3.630740 -0.648489
H 0.662632 2.911743 1.650807
H 1.109573 1.264189 1.240704
H 2.948443 2.393049 0.388352
H 2.872494 3.436381 -1.032489
H -1.652401 2.618644 0.813577
H -1.244127 1.337785 1.992100
H 4.072370 1.381382 -1.559061
H 2.559529 1.422465 -2.525078
H -1.137533 0.981916 -0.990095
H 1.910042 -0.532816 -1.521316
H -2.487021 -1.487976 -1.306353
H -3.231987 -0.030783 -1.977183
H 2.698275 -1.850618 1.806186
H 3.551055 -2.558570 0.430811
H -4.558429 -1.957029 0.072015
H -5.320783 -0.458203 -0.527906
H 1.491490 -2.825441 -0.847822
H 1.034525 -3.240454 0.809304


%chk=000244276-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000244276

0 1
Br -5.263822 -2.163304 -2.255790
Br 0.349750 -2.679730 -0.316690
O -3.351775 1.839102 -0.379318
O 4.416481 0.180541 0.293927
N -1.683476 0.572099 0.649709
N 2.410489 0.011161 -0.870655
C 0.605591 2.493298 -0.341998
C 0.387619 1.927873 1.082259
C 2.096770 2.537125 -0.773833
C -1.099819 1.683257 1.425715
C 2.575449 1.299545 -1.574958
C -2.757079 0.729768 -0.207614
C 3.349819 -0.454618 0.025227
C -3.177232 -0.543147 -0.969730
C 3.044191 -1.794677 0.724898
C -4.702972 -0.591695 -1.098814
C 2.383140 -2.908519 -0.089717
H 0.021312 1.895056 -1.071531
H 0.174042 3.512391 -0.378911
H 0.802944 2.638369 1.824598
H 0.956712 0.985128 1.207824
H 2.749166 2.660088 0.111611
H 2.276608 3.418796 -1.420223
H -1.709774 2.574895 1.196094
H -1.207920 1.467821 2.507128
H 3.649048 1.413646 -1.808425
H 2.016131 1.231394 -2.526939
H -1.248929 -0.350866 0.733586
H 1.541328 -0.514417 -1.000019
H -2.800606 -1.458310 -0.476749
H -2.727922 -0.502640 -1.980285
H 2.469839 -1.597791 1.650810
H 4.030580 -2.174905 1.056258
H -5.209066 -0.751212 -0.135548
H -5.096013 0.304797 -1.596632
H 2.754570 -2.975348 -1.123306
H 2.453427 -3.883568 0.414041


