%chk=000212324.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000212324

0 1
Br -4.337287 2.477295 0.160474
O -0.298180 0.245956 -2.088766
O 0.771569 -3.829883 1.344647
N 0.822222 -1.514377 -1.000335
N -0.390683 -1.932882 1.707481
C 0.179574 -0.184268 -0.767906
C 1.285792 -1.506816 -2.423480
C -1.041648 -0.104740 0.133102
C 0.470153 -0.405444 -3.127049
C -0.015869 -2.689440 -0.650909
C 1.237236 0.799089 -0.273731
C -1.236385 -0.855313 1.309380
C 0.181678 -2.894509 0.844693
C -1.988091 0.883627 -0.199763
C 1.282175 2.093101 -0.809804
C 2.139889 0.422345 0.728971
C -2.326001 -0.564698 2.165776
C -3.069059 1.136493 0.638602
C -3.238043 0.430446 1.836140
C 2.227184 3.008733 -0.340823
C 3.084425 1.342433 1.194086
C 3.128293 2.634798 0.661983
H 1.189072 -2.492608 -2.913127
H 2.371695 -1.258325 -2.403557
H 1.096767 0.370307 -3.595396
H -0.281013 -0.782062 -3.838799
H 0.356160 -3.600451 -1.177827
H -1.093426 -2.588571 -0.910913
H -1.856086 1.453464 -1.130174
H -0.283285 -2.094421 2.715239
H 0.578240 2.375839 -1.594613
H 2.112612 -0.589022 1.137694
H -2.460142 -1.131341 3.087332
H -4.076691 0.649575 2.500612
H 2.260466 4.014370 -0.755664
H 3.787298 1.049212 1.971911
H 3.863188 3.349688 1.027512


%chk=000212324-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000212324

0 1
Br -4.169866 2.765396 0.454132
O -0.357763 0.129941 -2.157905
O 0.382024 -4.206660 1.161157
N 0.785702 -1.526518 -0.909627
N -0.549985 -2.135945 1.620955
C 0.154891 -0.212843 -0.754882
C 1.506554 -1.418189 -2.208583
C -1.058824 -0.131717 0.177976
C 0.578242 -0.525445 -3.103451
C -0.096442 -2.707623 -0.737787
C 1.213141 0.835348 -0.337267
C -1.300454 -0.963994 1.309395
C -0.067102 -3.105188 0.736536
C -1.935842 0.959446 -0.058451
C 1.237073 2.122555 -0.924164
C 2.145071 0.513749 0.680364
C -2.358212 -0.636375 2.203091
C -2.985105 1.246504 0.825734
C -3.197253 0.468799 1.983252
C 2.183837 3.080665 -0.496712
C 3.090514 1.472309 1.106683
C 3.111359 2.760226 0.521248
H 1.697078 -2.417135 -2.629471
H 2.473319 -0.914411 -2.040938
H 1.155527 0.241750 -3.651349
H -0.031094 -1.112647 -3.812889
H 0.316598 -3.557900 -1.300518
H -1.139521 -2.528113 -1.081696
H -1.770051 1.576370 -0.943818
H -0.547795 -2.435511 2.601756
H 0.524588 2.356822 -1.722034
H 2.132575 -0.492270 1.113191
H -2.538956 -1.279510 3.072452
H -4.004848 0.702373 2.682097
H 2.199088 4.073986 -0.959391
H 3.810915 1.215290 1.891530
H 3.844818 3.504064 0.852381


