%chk=000200922.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000200922

0 1
Br -4.984865 0.719632 -0.554792
P 2.051648 -0.320891 0.700362
O 3.035054 -0.807825 1.702873
N 1.653148 -1.448494 -0.591429
N 2.511834 1.156131 -0.093665
N 0.533781 -0.133872 1.618460
N -1.811024 -0.274320 1.905872
N -0.861380 0.588694 -0.186733
C 2.324516 -2.785663 -0.567711
C 2.693566 -1.761675 -1.619811
C 1.796230 1.770717 -1.250251
C 1.827802 2.468570 0.095114
C -0.729805 0.049820 1.085380
C -3.048204 -0.066399 1.413357
C -2.118904 0.772635 -0.652791
C -3.248701 0.455152 0.118619
H 1.672276 -3.629574 -0.822420
H 3.038221 -3.061036 0.220429
H 3.680614 -1.287736 -1.619874
H 2.305943 -1.857818 -2.641704
H 0.860019 1.354890 -1.644138
H 2.454091 2.108920 -2.059507
H 2.506895 3.313440 0.265529
H 0.913583 2.567905 0.688656
H 0.552940 -0.479385 2.607927
H -3.891465 -0.327766 2.070784
H -2.206115 1.190449 -1.666540


%chk=000200922-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000200922

0 1
Br -5.192674 0.730658 -0.375254
P 2.074641 -0.262390 0.590863
O 3.130730 -0.700587 1.708996
N 1.787240 -1.364436 -0.783399
N 2.483304 1.211583 -0.247240
N 0.495860 -0.254355 1.437251
N -1.795547 -0.372847 1.870053
N -0.977390 0.599874 -0.221087
C 2.182432 -2.818201 -0.584113
C 3.012783 -1.926634 -1.486874
C 1.708176 1.933409 -1.311793
C 1.963737 2.585994 0.043960
C -0.789857 -0.000648 1.000189
C -3.071046 -0.145237 1.464226
C -2.265108 0.801104 -0.612174
C -3.355665 0.432813 0.204675
H 1.475605 -3.531095 -1.017435
H 2.623056 -3.097879 0.381330
H 4.001681 -1.623734 -1.121591
H 2.905100 -1.991309 -2.573314
H 0.689350 1.584194 -1.508629
H 2.316062 2.224866 -2.174558
H 2.735684 3.353260 0.155085
H 1.103004 2.680338 0.718270
H 0.557187 -0.612793 2.396690
H -3.868635 -0.433366 2.156659
H -2.418011 1.271919 -1.588789