%chk=000230175.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000230175

0 1
Br 1.784467 4.195476 -0.525315
Br -2.229666 2.375469 2.165048
O 1.605698 1.154181 0.080055
O -1.641295 -2.301127 -1.588427
O -3.645293 -2.098149 -0.330299
C 0.362193 1.846867 0.316413
C -0.768098 0.835691 0.207165
C 0.320563 2.871121 -0.835795
C 3.455234 -0.128246 0.725211
C 2.240209 0.615341 1.275467
C 3.164485 -1.609176 0.457490
C -0.569739 -0.249950 -0.691108
C 4.383342 -2.320186 -0.146595
C -1.947426 0.933202 0.941092
C -1.586727 -1.166167 -0.793590
C -0.990047 3.611664 -0.952439
C -2.794150 -1.045769 -0.035536
C -3.002146 -0.007453 0.841282
C 4.100238 -3.797402 -0.409876
C -2.942048 -2.923045 -1.320269
H 0.386033 2.342497 1.313937
H 0.602142 2.368882 -1.791274
H 3.771957 0.371909 -0.218229
H 4.306865 -0.021221 1.423453
H 2.525607 1.464131 1.921192
H 1.524381 -0.037274 1.800880
H 2.298263 -1.698507 -0.228201
H 2.861574 -2.114030 1.394531
H 0.369162 -0.334359 -1.245033
H 5.253308 -2.221180 0.531575
H 4.678506 -1.822403 -1.091475
H -0.979413 4.329435 -1.785371
H -1.235317 4.184255 -0.045682
H -1.827568 2.920963 -1.132678
H -3.918266 0.084420 1.423346
H 3.844387 -4.330914 0.512446
H 3.264928 -3.929710 -1.107255
H 4.973142 -4.295877 -0.846086
H -3.524815 -2.901523 -2.250709
H -2.759072 -3.907135 -0.868743


%chk=000230175-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000230175

0 1
Br 1.910648 3.990730 -0.994344
Br -2.011729 2.534607 2.334216
O 1.648853 0.992877 0.100615
O -2.061826 -2.368957 -1.353109
O -3.936371 -1.995830 0.101696
C 0.406658 1.764099 0.178201
C -0.804383 0.821523 0.239044
C 0.368661 2.637681 -1.095901
C 3.401860 -0.295679 1.182614
C 2.060634 0.412274 1.395069
C 3.321863 -1.507543 0.227467
C -0.788493 -0.317117 -0.627462
C 4.683922 -2.213853 0.044844
C -1.919874 1.006925 1.090380
C -1.881311 -1.177173 -0.609644
C -0.929685 3.416236 -1.324236
C -2.984406 -0.961989 0.245855
C -3.033247 0.122939 1.120722
C 4.609523 -3.425879 -0.908721
C -3.443169 -2.821669 -1.038260
H 0.412473 2.422464 1.070457
H 0.644683 2.021588 -1.968612
H 4.130536 0.441249 0.792311
H 3.775247 -0.626410 2.173782
H 2.156309 1.230570 2.140888
H 1.285920 -0.302583 1.749420
H 2.946499 -1.166034 -0.756714
H 2.578853 -2.236072 0.616115
H 0.089096 -0.500199 -1.252968
H 5.061515 -2.543387 1.035006
H 5.422502 -1.481951 -0.341137
H -0.845306 4.044746 -2.225657
H -1.165623 4.067922 -0.466164
H -1.771833 2.713578 -1.469043
H -3.877537 0.281077 1.793838
H 3.896915 -4.183548 -0.531115
H 4.267929 -3.117374 -1.914800
H 5.594810 -3.914670 -1.021618
H -4.091745 -2.643439 -1.915486
H -3.413774 -3.877030 -0.726952


