%chk=000293417.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000293417

0 1
Br -4.386879 -0.682647 1.024426
Br -2.867288 2.624190 0.447416
F 0.730947 0.778908 2.197974
F 1.573240 2.063040 0.737154
F 2.811450 0.766223 1.868035
F 2.334575 0.845691 -1.849319
F 3.799178 0.033742 -0.555582
F 2.639766 -1.251384 -1.760637
O 1.742463 -1.553823 0.797123
O -0.209671 1.919992 -0.790468
C -0.828972 -1.653531 -0.026339
C 0.049911 -0.425687 -0.462769
C -2.210876 -1.464555 -0.715686
C -2.983664 -0.188004 -0.355178
C 1.471018 -0.328536 0.150519
C -2.066646 0.846663 0.315243
C -0.705032 0.912744 -0.361398
C -0.983309 -1.793585 1.487193
C -0.212443 -2.942745 -0.598116
C -3.731213 0.352926 -1.559693
C 1.640121 0.818321 1.215339
C 2.545499 -0.156052 -0.992540
H 0.169581 -0.572275 -1.578966
H -2.067122 -1.500655 -1.817667
H -2.827339 -2.366918 -0.511673
H -1.880532 0.547836 1.394085
H -0.831492 -3.817709 -0.368189
H -0.080894 -2.910656 -1.683453
H 0.777898 -3.141354 -0.159876
H -1.407139 -0.902167 1.969474
H -1.654387 -2.624913 1.741354
H -0.018924 -2.004362 1.972032
H -4.487357 1.112145 -1.296639
H -4.278915 -0.434927 -2.095237
H -3.051282 0.838452 -2.274924
H 2.661627 -1.605988 1.169284


%chk=000293417-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000293417

0 1
Br -4.234568 -0.371645 1.277337
Br -2.538733 2.862226 0.084710
F 0.660728 0.291089 2.429163
F 1.038310 2.000319 1.015171
F 2.784402 0.856780 1.917023
F 2.571632 1.539450 -1.144535
F 3.891823 -0.140436 -0.393549
F 2.459178 -0.511716 -2.094145
O 1.971294 -1.584087 0.711070
O -0.327516 1.521766 -1.728369
C -0.839238 -1.724513 0.013079
C 0.116440 -0.563343 -0.516596
C -2.225035 -1.438964 -0.653837
C -2.942268 -0.089470 -0.328385
C 1.505709 -0.317817 0.186829
C -1.886102 0.967840 0.107618
C -0.651459 0.769424 -0.786565
C -0.979407 -1.916409 1.545524
C -0.334492 -3.071603 -0.585721
C -3.823938 0.343595 -1.509522
C 1.482917 0.719078 1.374256
C 2.587772 0.172963 -0.874667
H 0.395832 -0.894664 -1.534503
H -2.081822 -1.449249 -1.756301
H -2.913766 -2.270000 -0.424778
H -1.597814 0.801120 1.156204
H -1.021115 -3.890343 -0.301760
H -0.291122 -3.035581 -1.691467
H 0.670656 -3.312191 -0.207408
H -1.355386 -1.032972 2.082487
H -1.704759 -2.730030 1.727882
H -0.014597 -2.207319 1.988537
H -4.474684 1.189151 -1.243250
H -4.454854 -0.500938 -1.835054
H -3.181436 0.656688 -2.355785
H 2.913317 -1.499799 1.021608


