%chk=000241649.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000241649

0 1
Br 3.945553 2.420969 2.306626
Br -3.424488 3.393956 -1.173287
O 0.979912 1.272743 -1.133819
O -1.677213 0.053005 1.641156
N 1.277465 -0.970466 -0.891780
N -1.408624 -1.442973 -0.047527
C 0.646033 -2.146864 1.248065
C 1.555461 -2.117127 0.011104
C -0.830079 -2.416926 0.920017
C 0.275280 -1.204146 -1.961702
C -1.107697 -1.705515 -1.470687
C 1.494616 0.364409 -0.494517
C -1.705600 -0.147913 0.436347
C 2.438863 0.608548 0.665881
C -2.115588 0.905951 -0.570068
C 2.683201 2.098874 0.832349
C -2.856719 2.031126 0.129915
H 1.008186 -2.920726 1.953673
H 0.719888 -1.185077 1.805044
H 2.623971 -2.071381 0.323152
H 1.445261 -3.060152 -0.570552
H -0.964551 -3.441806 0.514098
H -1.431252 -2.353724 1.861774
H 0.703053 -1.942043 -2.676819
H 0.148403 -0.251138 -2.536530
H -1.905681 -1.244714 -2.099256
H -1.186367 -2.803737 -1.643144
H 3.398306 0.068812 0.505026
H 2.002325 0.178578 1.599687
H -2.731240 0.474811 -1.387203
H -1.188440 1.300803 -1.070563
H 1.750835 2.646530 1.068590
H 3.114764 2.553410 -0.079067
H -2.218952 2.537097 0.880011
H -3.767184 1.675104 0.644406


%chk=000241649-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000241649

0 1
Br 3.918610 2.876723 1.905389
Br -3.572862 3.611660 -0.532104
O 1.217105 1.014700 -1.548708
O -2.159461 -0.331985 1.709654
N 1.418211 -1.149056 -0.739660
N -1.322362 -1.329972 -0.210183
C 0.450160 -2.253423 1.324369
C 1.660243 -2.108543 0.366404
C -0.902538 -2.496848 0.606986
C 0.567529 -1.622440 -1.851120
C -0.949299 -1.312306 -1.635325
C 1.674674 0.212801 -0.666393
C -1.934494 -0.272202 0.455142
C 2.548489 0.716188 0.493572
C -2.334629 0.966724 -0.364201
C 2.752247 2.229846 0.374476
C -3.043138 1.974185 0.547054
H 0.649245 -3.097663 2.013931
H 0.337669 -1.348615 1.949100
H 2.553528 -1.800243 0.934876
H 1.895904 -3.088987 -0.090702
H -0.854093 -3.383766 -0.053465
H -1.679479 -2.672098 1.369973
H 0.734538 -2.708921 -1.954224
H 0.890547 -1.126963 -2.782688
H -1.163314 -0.318168 -2.049434
H -1.546101 -2.057297 -2.200437
H 3.528862 0.203025 0.482361
H 2.074860 0.477376 1.464443
H -3.003207 0.682154 -1.198198
H -1.436103 1.430109 -0.816055
H 1.813749 2.793453 0.459437
H 3.282385 2.516472 -0.543099
H -2.396360 2.348123 1.351498
H -3.979413 1.584250 0.967729


