%chk=000237222.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000237222

0 1
Br 2.862397 -1.829929 -0.283403
O 1.128321 0.837737 -0.475703
O 0.324781 1.047885 1.625421
C -1.203818 0.642434 -0.286714
C -1.879000 -0.634269 0.240964
C -1.014142 -1.905164 0.082652
C -2.104318 1.877114 -0.090148
C -0.639278 -2.162885 -1.380144
C -1.764548 -3.108034 0.669981
C 0.101381 0.864471 0.452849
C -1.554203 3.110061 -0.798983
C 2.490095 1.013023 -0.008642
C 2.952293 -0.190986 0.789444
H -0.982655 0.516376 -1.380603
H -2.138033 -0.503073 1.311412
H -2.841574 -0.773914 -0.288576
H -0.067695 -1.766212 0.666140
H -3.119887 1.648364 -0.471000
H -2.227328 2.084960 0.993361
H -1.517944 -2.199819 -2.030279
H -0.108684 -3.115510 -1.489157
H 0.033972 -1.382103 -1.759170
H -2.022778 -2.948438 1.722161
H -2.692578 -3.314513 0.126897
H -1.151105 -4.014904 0.620639
H -0.570380 3.400132 -0.410137
H -1.442372 2.945821 -1.877381
H -2.220695 3.970769 -0.666418
H 2.539028 1.937273 0.600195
H 3.033724 1.143728 -0.964928
H 3.995557 -0.079168 1.132036
H 2.309766 -0.351528 1.680632


%chk=000237222-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000237222

0 1
Br 3.387493 -1.724752 -0.443595
O 1.211231 0.833866 -0.514356
O 0.268572 1.120876 1.598848
C -1.196764 0.646262 -0.343008
C -1.871832 -0.640458 0.216723
C -1.067036 -1.957500 0.052853
C -2.126038 1.880833 -0.155546
C -0.783038 -2.296662 -1.429790
C -1.820854 -3.117990 0.745222
C 0.121859 0.889106 0.375431
C -1.569564 3.180660 -0.773852
C 2.551567 1.065640 0.078065
C 3.098903 -0.156421 0.806435
H -0.976755 0.520011 -1.418007
H -2.084579 -0.475486 1.292106
H -2.850882 -0.753943 -0.293643
H -0.089442 -1.836326 0.566400
H -3.102716 1.636623 -0.617321
H -2.306954 2.024721 0.927291
H -1.728434 -2.376278 -2.001831
H -0.255160 -3.264707 -1.511095
H -0.145389 -1.535093 -1.912512
H -2.008952 -2.897122 1.812718
H -2.799210 -3.296518 0.257585
H -1.240542 -4.057388 0.688453
H -0.625031 3.486146 -0.287037
H -1.368643 3.056742 -1.854305
H -2.288602 4.011335 -0.654838
H 2.483865 1.898720 0.805747
H 3.181997 1.351719 -0.777321
H 4.093044 0.059221 1.228952
H 2.416186 -0.516137 1.588626


