%chk=000278701.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000278701

0 1
Br 2.840409 -2.330192 -0.475474
O 4.307791 0.110969 1.072447
O 4.293750 0.501766 -1.058514
N 3.750786 0.307352 0.010780
C -0.514478 0.159301 0.009642
C -1.991688 0.073405 0.000811
C 0.251347 -1.004541 -0.214139
C 0.118002 1.391546 0.238699
C 2.258737 0.334546 0.025595
C 1.633588 -0.898790 -0.201698
C 1.514876 1.490669 0.247507
C -2.725181 0.473845 1.128519
C -2.660009 -0.408678 -1.135513
C -4.119826 0.389189 1.116919
C -4.055091 -0.485236 -1.141407
C -4.785827 -0.088262 -0.016649
H -0.239526 -1.964795 -0.385416
H -0.485985 2.285929 0.405067
H 2.004760 2.450109 0.422916
H -2.208033 0.841502 2.014015
H -2.092684 -0.715495 -2.013667
H -4.688872 0.695836 1.993950
H -4.573937 -0.855746 -2.024959
H -5.873209 -0.151327 -0.023433


%chk=000278701-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000278701

0 1
Br 2.603133 -2.459496 -1.166398
O 4.289055 1.214706 0.968524
O 4.516760 -0.117567 -0.869682
N 3.805921 0.454000 0.038842
C -0.512085 0.142351 0.016861
C -1.998504 0.065260 0.001841
C 0.272694 -0.927002 -0.493787
C 0.166177 1.275351 0.548534
C 2.335070 0.271580 0.017617
C 1.680787 -0.872614 -0.508730
C 1.566204 1.332455 0.556818
C -2.768878 0.689025 1.022553
C -2.683497 -0.630469 -1.032975
C -4.177299 0.616049 1.010627
C -4.091921 -0.700558 -1.046652
C -4.845842 -0.078642 -0.024280
H -0.219390 -1.834704 -0.853761
H -0.406252 2.127080 0.927527
H 2.100031 2.195253 0.964293
H -2.264300 1.202994 1.848321
H -2.114755 -1.088673 -1.850005
H -4.752443 1.092657 1.811817
H -4.601255 -1.231854 -1.857870
H -5.939710 -0.134280 -0.034038


