%chk=000159972.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000159972

0 1
 Br   2.651500       3.463300     -0.3463000    
 O   -5.208700     -0.8385000      0.3355000    
 O    3.818700      0.5770000      0.1482000    
 O    5.829200     -0.3401000     -0.2926000    
 C   -2.755700     -0.5424000      0.2027000    
 C   -1.934400      0.7066000     -0.1853000    
 C  -0.4866000      0.6551000      0.3213000    
 C   0.2116000     -0.6058000     -0.2797000    
 C    1.711800     -0.7035000      0.1639000    
 C   -4.163600     -0.1370000     -0.3345000    
 C   -2.086700      -1.764600     -0.4487000    
 C  -0.6089000      -1.898500     -3.5799999E-02
 C   -2.819300       1.867400      0.2571000    
 C   0.2835000       1.932500     -4.5400001E-02
 C   -4.257700       1.370800      2.1000000E-02
 C    2.430800      0.6029000     -0.2482000    
 C    1.759000       1.845900      0.3392000    
 C   -2.837000     -0.7778000       1.739500    
 C    2.451500      -1.813500     -0.6094000    
 C    1.839200     -0.9733000       1.684100    
 C   -4.387800     -0.3471000      -1.837100    
 C    3.950100      -1.815300     -0.3427000    
 C    4.609500     -0.4640000     -0.2066000    
 H   -1.873700      0.7656000      -1.282800    
 H  -0.4971000      0.5896000       1.413700    
 H   0.2176000     -0.4650000      -1.372600    
 H   -2.115900      -1.684600      -1.541800    
 H   -2.626800      -2.682900     -0.1893000    
 H  -0.5536000      -2.197800       1.015000    
 H  -0.1782000      -2.725400     -0.6116000    
 H   -2.615800       2.777200     -0.3168000    
 H   -2.668600       2.105600       1.316100    
 H   0.1869000       2.113300      -1.124900    
 H  -0.1729000       2.797200      0.4525000    
 H   -4.863900       1.538900      0.9192000    
 H   -4.728400       1.946200     -0.7846000    
 H    2.425100      0.6953000      -1.344700    
 H    1.897800       1.904300       1.423600    
 H   -3.348200      3.7799999E-02   2.260800    
 H   -3.391100      -1.698100       1.958700    
 H   -1.856400     -0.8845000       2.209600    
 H    2.290100      -1.677300      -1.687400    
 H    2.052900      -2.804400     -0.3634000    
 H    1.281100     -0.2510000       2.285100    
 H    1.470400      -1.971600       1.941600    
 H    2.876400     -0.9232000       2.030500    
 H   -3.653200      0.1761000      -2.455100    
 H   -4.366400      -1.412200      -2.093000    
 H   -5.384400      7.4999998E-03  -2.126500    
 H    4.449500      -2.356000      -1.155000    
 H    4.153200      -2.359900      0.5870000    
 H   -5.091900      -1.786700      0.1539000    


%chk=000159972-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000159972

0 1
Br 2.711991 3.553715 -0.351892
O -5.307400 -0.807729 0.376587
O 3.870856 0.629638 0.075822
O 5.903997 -0.391125 -0.063297
C -2.764609 -0.555700 0.212511
C -1.934597 0.715490 -0.155873
C -0.474841 0.656114 0.341352
C 0.215657 -0.606732 -0.269208
C 1.725769 -0.709562 0.151850
C -4.191470 -0.140864 -0.339176
C -2.081024 -1.784463 -0.436368
C -0.596992 -1.903473 0.008825
C -2.837709 1.893113 0.291021
C 0.296708 1.944713 -0.049620
C -4.291078 1.379306 0.024504
C 2.426218 0.619956 -0.288399
C 1.783155 1.861085 0.324618
C -2.880332 -0.764923 1.747936
C 2.453796 -1.814381 -0.668768
C 1.895711 -0.970588 1.673191
C -4.386216 -0.385013 -1.851473
C 3.972667 -1.852529 -0.385389
C 4.667446 -0.507411 -0.151541
H -1.876172 0.749557 -1.267907
H -0.480140 0.579144 1.447755
H 0.206172 -0.453763 -1.375624
H -2.107655 -1.692195 -1.540718
H -2.615646 -2.721163 -0.175773
H -0.550918 -2.153482 1.085201
H -0.137255 -2.753519 -0.530272
H -2.619456 2.823509 -0.262055
H -2.685711 2.111639 1.365120
H 0.209656 2.107105 -1.142940
H -0.153754 2.824652 0.441975
H -4.936214 1.480857 0.913653
H -4.777032 1.939185 -0.793987
H 2.366150 0.698449 -1.394296
H 1.955617 1.903651 1.411841
H -3.405662 0.071183 2.238476
H -3.468085 -1.674127 1.962637
H -1.893652 -0.877898 2.228273
H 2.276356 -1.626426 -1.747015
H 2.027761 -2.808643 -0.443822
H 1.242058 -0.324114 2.283398
H 1.646431 -2.018828 1.915920
H 2.932650 -0.786189 2.003074
H -3.617226 0.123201 -2.460589
H -4.356893 -1.463050 -2.103258
H -5.373426 0.006809 -2.154038
H 4.521472 -2.364366 -1.195652
H 4.178737 -2.439932 0.530523
H -5.371363 -1.745788 0.060886


