%chk=000289850.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000289850

0 1
Br -2.530004 2.823356 -1.407853
O -1.761229 0.691523 1.571027
O 0.851099 -0.217014 1.970855
O -0.982107 -0.151055 -2.981102
O 2.452134 1.177917 -2.258435
O -1.802671 -2.861455 -2.342981
O 3.661012 -1.419714 -2.409287
C 0.075301 1.150092 -0.636010
C -1.108034 0.207127 -0.621130
C 1.329500 0.369867 -0.321452
C -0.129103 2.416535 0.175238
C -1.983529 0.012080 0.393474
C 1.610711 -0.265195 0.848392
C -1.333353 -0.528822 -1.896659
C 2.329320 0.331602 -1.411124
C -3.161650 -0.877414 0.311334
C 2.828280 -1.078454 1.073365
C -3.224752 -1.809783 -0.744422
C 3.652943 -1.383420 -0.029369
C -2.104529 -1.871219 -1.732653
C 3.278124 -0.901912 -1.393469
C -1.234083 3.253316 -0.061306
C 0.807435 2.840009 1.132296
C -4.206896 -0.813560 1.239312
C 3.167015 -1.548936 2.346692
C -4.314317 -2.677395 -0.853945
C 4.802213 -2.156829 0.149206
C -1.429929 4.440546 0.646956
C 0.625801 4.027266 1.846544
C -0.495745 4.826544 1.612391
C -5.304156 -1.674774 1.117718
C 4.326592 -2.315405 2.520505
C -5.357932 -2.605322 0.077263
C 5.141651 -2.618039 1.428084
H 0.183011 1.518588 -1.718065
H 1.708079 2.252607 1.315131
H -4.175970 -0.086568 2.052786
H 2.522006 -1.317838 3.198320
H -4.342446 -3.408698 -1.667810
H 5.426870 -2.400780 -0.715288
H -2.297083 5.072377 0.446770
H 1.368365 4.332629 2.583563
H -0.638650 5.751773 2.168221
H -6.119973 -1.616132 1.840182
H 4.589327 -2.677900 3.515053
H -2.460324 0.509465 2.256742
H 0.035079 0.384776 1.874019
H -6.212267 -3.277819 -0.012550
H 6.042363 -3.217245 1.565574


%chk=000289850-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000289850

0 1
Br -2.305578 2.854818 -1.918922
O -1.629996 0.482690 1.648812
O 0.781609 -0.500924 1.939054
O -0.586250 -0.689942 -2.846213
O 2.321931 1.169830 -2.332891
O -3.034991 -2.027096 -3.112471
O 4.662644 -0.328097 -2.024308
C 0.071958 0.999280 -0.649723
C -1.141752 0.059520 -0.630123
C 1.386842 0.286430 -0.303119
C -0.147561 2.351060 0.052740
C -1.997455 -0.134662 0.433321
C 1.646194 -0.416058 0.870956
C -1.399045 -0.697848 -1.880695
C 2.449813 0.420660 -1.317572
C -3.214349 -0.963744 0.414267
C 2.909981 -1.150021 1.112940
C -3.595227 -1.606073 -0.803083
C 3.945448 -1.136974 0.133619
C -2.727550 -1.497637 -2.011285
C 3.776248 -0.363514 -1.128147
C -1.146745 3.265232 -0.374789
C 0.686422 2.785638 1.116224
C -4.030941 -1.140408 1.561088
C 3.101531 -1.878129 2.313038
C -4.780257 -2.374152 -0.864427
C 5.146657 -1.850484 0.360279
C -1.337585 4.523467 0.231658
C 0.519014 4.040933 1.736691
C -0.502872 4.912614 1.302523
C -5.216122 -1.905408 1.489771
C 4.302925 -2.587317 2.530644
C -5.598534 -2.520335 0.274926
C 5.328826 -2.576846 1.554804
H 0.207233 1.240211 -1.728077
H 1.499663 2.132534 1.447704
H -3.756097 -0.711141 2.532704
H 2.304606 -1.882240 3.060181
H -5.033645 -2.851122 -1.816805
H 5.919474 -1.816529 -0.414562
H -2.115044 5.197406 -0.139831
H 1.189938 4.338701 2.549435
H -0.642685 5.892491 1.770842
H -5.834807 -2.028502 2.384607
H 4.439861 -3.149145 3.460861
H -2.379262 0.664933 2.264452
H -0.083026 0.019623 1.859436
H -6.516546 -3.113809 0.223905
H 6.258604 -3.128621 1.727662


