%chk=000221872.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000221872

0 1
Br 4.626812 3.014706 -0.483205
S 0.703697 -2.044089 -0.017820
O 1.354491 -3.068173 0.771951
O 0.152973 -2.339497 -1.317862
N -0.544163 -1.483135 1.022806
C 1.755653 -0.674259 -0.150962
C -1.603957 -0.605716 0.656084
C -1.971625 -0.409516 -0.687341
C -2.284364 0.088095 1.679814
C -3.659827 1.200435 0.011122
C 2.898870 -0.606576 0.652222
C 1.471078 0.348995 -1.059606
C -2.988717 0.492872 -0.997753
C -3.302418 0.980488 1.351379
C 3.760494 0.490683 0.557884
C 2.323760 1.453471 -1.163624
C 3.457578 1.508760 -0.349936
C -4.756956 2.154784 -0.332432
H -0.594232 -1.854404 1.980367
H -1.505090 -0.986851 -1.492419
H -2.017586 -0.067091 2.722095
H 3.129527 -1.418341 1.354409
H 0.583180 0.293333 -1.700585
H -3.269820 0.637613 -2.040846
H -3.824608 1.512346 2.146041
H 4.652889 0.542697 1.184037
H 2.099896 2.253192 -1.871908
H -5.730220 1.641588 -0.340497
H -4.620980 2.606678 -1.323731
H -4.830937 2.980515 0.387315


%chk=000221872-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000221872

0 1
Br 4.128991 3.428040 0.026473
S 0.743845 -2.250818 -0.229387
O 1.616377 -3.371190 0.562108
O 0.226083 -2.427707 -1.757212
N -0.881147 -2.058856 0.859384
C 1.714625 -0.623131 -0.164784
C -1.693967 -0.930381 0.565280
C -2.420115 -0.912601 -0.659192
C -1.837981 0.156900 1.473957
C -3.452670 1.242548 -0.037905
C 2.705241 -0.485490 0.822079
C 1.412167 0.375405 -1.105531
C -3.271610 0.168855 -0.952754
C -2.724957 1.211477 1.181380
C 3.430236 0.726348 0.875250
C 2.135725 1.588362 -1.045588
C 3.128510 1.747196 -0.053892
C -4.419959 2.371775 -0.340416
H -0.510470 -2.079778 1.828344
H -2.306740 -1.751483 -1.352118
H -1.266791 0.163471 2.411374
H 2.928098 -1.310615 1.506595
H 0.654102 0.205780 -1.876297
H -3.823762 0.172494 -1.900119
H -2.844582 2.030547 1.900664
H 4.216671 0.866958 1.621631
H 1.929439 2.388146 -1.761720
H -5.433131 2.136810 0.040726
H -4.512991 2.547604 -1.426316
H -4.103838 3.316933 0.134986


