%chk=000218853.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000218853

0 1
Br 2.633528 -2.349409 -1.435423
Br 7.288585 -0.511265 1.327453
S -6.859887 0.659730 1.126792
O 1.699500 0.407220 -0.591139
N -4.927627 -0.378114 -0.423224
N 3.592710 1.197633 0.554994
C -3.623909 -0.175851 0.291145
C -2.670789 0.604378 -0.630307
C -5.706716 -1.534234 0.119916
C -1.295792 0.774525 0.025012
C -5.795771 0.808904 -0.387493
C -6.539358 -1.122393 1.340301
C -0.330354 1.530523 -0.895973
C 1.047925 1.701910 -0.273552
C 2.958697 0.212154 -0.151815
C 3.569062 -1.036590 -0.457533
C 4.868984 -1.258307 -0.016020
C 4.860887 0.962015 0.977649
C 5.520007 -0.247698 0.709027
H -3.741549 0.346713 1.265126
H -3.184184 -1.171655 0.518299
H -2.575386 0.069990 -1.597754
H -3.101550 1.592744 -0.880106
H -6.371678 -1.888728 -0.702061
H -5.028143 -2.379204 0.356205
H -1.398010 1.308068 0.989787
H -0.862924 -0.217958 0.268538
H -6.454190 0.811523 -1.280816
H -5.240353 1.763776 -0.353627
H -7.496622 -1.666901 1.397610
H -6.004920 -1.285465 2.291337
H -0.226927 0.981847 -1.859445
H -0.741363 2.525850 -1.157341
H 1.043310 1.824923 0.821863
H 1.646524 2.500423 -0.743150
H 5.376742 -2.205338 -0.229937
H 5.339841 1.775361 1.542262


%chk=000218853-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000218853

0 1
Br 2.458569 -2.617625 -0.900745
Br 7.358598 -0.489877 1.443416
S -6.677383 0.590512 1.545458
O 1.645784 0.364594 -0.522725
N -5.004930 -0.327934 -0.472938
N 3.639196 1.213327 0.427811
C -3.638054 -0.215847 0.115580
C -2.711607 0.691105 -0.718417
C -5.770516 -1.514996 -0.023528
C -1.286104 0.762790 -0.127551
C -5.853619 0.818343 -0.260031
C -6.306754 -1.267304 1.429533
C -0.348625 1.668770 -0.956198
C 1.076769 1.742718 -0.409153
C 2.931533 0.172237 -0.079228
C 3.492873 -1.136633 -0.169561
C 4.806676 -1.348498 0.278332
C 4.915101 1.018643 0.865076
C 5.526327 -0.247427 0.804496
H -3.685399 0.157198 1.165817
H -3.206816 -1.234188 0.144343
H -2.676484 0.301150 -1.754075
H -3.136231 1.713973 -0.778446
H -6.630477 -1.653370 -0.704573
H -5.137492 -2.417124 -0.074746
H -1.333241 1.139516 0.915811
H -0.849679 -0.253352 -0.079389
H -6.699111 0.838549 -0.962847
H -5.304895 1.769436 -0.261780
H -7.233751 -1.830983 1.619019
H -5.552960 -1.521746 2.192435
H -0.313838 1.314073 -2.004504
H -0.750262 2.702681 -0.980419
H 1.108114 2.047178 0.653491
H 1.717675 2.431697 -0.988469
H 5.258929 -2.341588 0.221072
H 5.440383 1.891099 1.264233


