%chk=000275191.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000275191

0 1
Br -5.397475 -2.153672 -0.130269
O 1.566304 -3.625441 0.538035
O 5.093090 1.697686 -1.068042
O 5.504792 -0.958709 -0.763012
N -1.447252 2.597748 0.364959
N 0.874633 -1.443071 0.713971
C 0.353260 0.944374 0.550474
C -0.455454 1.822462 -0.456898
C -0.281757 -0.471886 0.803875
C 0.342002 1.794660 1.852902
C -1.105829 1.030898 -1.584457
C -2.112664 0.033955 -0.993493
C -1.388325 -0.953054 -0.114933
C -0.670502 2.934413 1.610524
C 1.765001 0.630673 0.118855
C -2.705842 1.863288 0.727627
C -3.171597 0.792718 -0.227112
C 2.038210 -0.757873 0.254534
C -1.658422 -2.268192 -0.136035
C 0.646699 -2.839479 0.614834
C 2.757413 1.499786 -0.319003
C -0.820008 -3.234951 0.643998
C 3.285406 -1.309877 -0.034915
C -4.486797 0.535324 -0.341538
C 4.011355 0.958809 -0.618271
C 4.279567 -0.428048 -0.476406
C -5.078486 -0.514620 -1.199397
H 0.233581 2.589431 -0.901955
H -0.676329 -0.515326 1.855956
H 1.347023 2.194664 2.072648
H 0.070670 1.188904 2.732710
H -0.331056 0.498990 -2.171237
H -1.616246 1.719602 -2.287011
H -2.596166 -0.523386 -1.842530
H -1.329036 3.106338 2.480200
H -0.151637 3.897198 1.415774
H -3.479525 2.667276 0.807657
H -2.641642 1.386507 1.736703
H -2.468300 -2.703722 -0.718112
H 2.566959 2.564221 -0.423735
H -1.175512 -3.301387 1.696793
H -0.914090 -4.268537 0.242240
H 3.485161 -2.380831 0.073396
H -5.218738 1.104344 0.238706
H -6.063704 -0.221645 -1.605717
H -4.427819 -0.818909 -2.041543
H 4.864074 2.652284 -1.152524
H 6.139316 -0.246840 -1.069426


%chk=000275191-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000275191

0 1
Br -5.987745 -1.937298 -0.575260
O 1.673887 -3.700766 0.531498
O 5.140953 1.784418 -1.089712
O 5.604768 -0.852435 -0.876761
N -1.515948 2.486664 0.381107
N 0.926065 -1.482573 0.641857
C 0.358107 0.905841 0.588986
C -0.507025 1.750922 -0.437960
C -0.233403 -0.539763 0.832724
C 0.308485 1.816137 1.877575
C -1.136888 0.934631 -1.568835
C -2.152879 -0.072251 -0.962312
C -1.398222 -1.032443 -0.042867
C -0.700262 2.972912 1.532470
C 1.780086 0.610018 0.128582
C -2.658144 1.639443 0.858085
C -3.215714 0.732026 -0.220827
C 2.080461 -0.770955 0.217727
C -1.641585 -2.367087 0.019119
C 0.737791 -2.858507 0.676238
C 2.771492 1.513655 -0.303423
C -0.738340 -3.255258 0.861178
C 3.350448 -1.294788 -0.105303
C -4.561576 0.669041 -0.452759
C 4.042849 1.007491 -0.639460
C 4.332256 -0.383149 -0.541077
C -5.244338 -0.189365 -1.452764
H 0.164529 2.518042 -0.872645
H -0.555960 -0.619188 1.893051
H 1.309102 2.216613 2.113113
H -0.020585 1.235998 2.758129
H -0.345780 0.396505 -2.123578
H -1.649987 1.614384 -2.272842
H -2.612804 -0.669114 -1.768049
H -1.350319 3.248696 2.380172
H -0.151374 3.878860 1.215020
H -3.445994 2.310621 1.242765
H -2.347501 0.985661 1.714758
H -2.453448 -2.828677 -0.554343
H 2.565085 2.589810 -0.369522
H -0.998378 -3.164892 1.939203
H -0.830243 -4.319363 0.596089
H 3.568060 -2.360672 -0.029568
H -5.222497 1.298492 0.158990
H -6.159709 0.261716 -1.859568
H -4.605320 -0.574010 -2.258547
H 4.917765 2.743192 -1.148898
H 6.164087 -0.082141 -1.161758


