%chk=000261858.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000261858

0 1
Br -2.883665 -2.093390 1.564611
O -0.691711 -0.054489 2.391652
C 0.817295 0.029223 0.542956
C 1.255992 -1.137252 -0.111818
C 1.613527 1.184890 0.607779
C 2.512150 -1.128217 -0.751357
C 2.867095 1.184364 -0.041322
C 3.295248 0.033176 -0.711809
C -0.531174 0.027538 1.198055
C 0.382449 -2.349368 -0.102276
C 1.152720 2.401400 1.345127
C 3.030987 -2.330824 -1.474269
C 3.746993 2.393669 -0.017539
C -1.693352 0.180075 0.248625
C -2.813125 -0.655806 0.306254
C -1.664379 1.206909 -0.706804
C -3.896860 -0.479572 -0.558051
C -2.744231 1.397259 -1.572475
C -3.859238 0.555928 -1.497224
H 4.264541 0.037603 -1.210678
H 0.072009 -2.611484 0.922555
H -0.534893 -2.185347 -0.687931
H 0.867302 -3.242413 -0.513387
H 1.940562 2.782032 2.013601
H 0.890994 3.214716 0.655444
H 0.282663 2.218229 1.992169
H 3.156992 -3.182220 -0.789596
H 2.344899 -2.643836 -2.274015
H 4.007453 -2.151841 -1.942608
H 4.653239 2.267211 -0.623755
H 3.224000 3.280257 -0.401737
H 4.076043 2.622995 1.006724
H -0.789683 1.857838 -0.772342
H -4.766383 -1.136346 -0.502975
H -2.716124 2.200381 -2.308023
H -4.702537 0.704410 -2.171962


%chk=000261858-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000261858

0 1
Br -3.258658 -1.426390 2.335430
O -0.668150 0.331218 2.411362
C 0.821662 0.158029 0.507647
C 1.209678 -0.978884 -0.267523
C 1.702831 1.265011 0.714509
C 2.497783 -0.990688 -0.873827
C 2.989729 1.236638 0.100661
C 3.354718 0.117830 -0.681408
C -0.542183 0.177838 1.162421
C 0.298666 -2.188647 -0.428026
C 1.312917 2.472939 1.551647
C 2.969767 -2.171172 -1.706108
C 3.968277 2.384739 0.277644
C -1.756595 0.090137 0.262781
C -3.005136 -0.478631 0.636764
C -1.668683 0.689957 -1.026410
C -4.118177 -0.441402 -0.229422
C -2.776722 0.748553 -1.894348
C -4.007284 0.182099 -1.492814
H 4.347441 0.103572 -1.149310
H -0.459977 -2.256456 0.367705
H -0.238485 -2.168092 -1.396839
H 0.882979 -3.125259 -0.402044
H 1.828123 2.449980 2.531468
H 1.609095 3.413578 1.052314
H 0.235392 2.517134 1.766373
H 3.086304 -3.085479 -1.091942
H 2.255704 -2.418202 -2.513889
H 3.946830 -1.958392 -2.172283
H 4.937496 2.154152 -0.196290
H 3.589363 3.322825 -0.172897
H 4.155924 2.600059 1.346344
H -0.709693 1.123445 -1.329332
H -5.062622 -0.898256 0.080179
H -2.681824 1.229404 -2.873363
H -4.878691 0.214508 -2.155572


