%chk=000275301.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000275301

0 1
Br -0.037356 0.100164 -3.406970
Br 1.383597 -1.709710 1.844374
O 1.759617 -0.794510 -1.171644
O -3.496323 2.333830 0.215046
O -4.802042 1.262641 -1.261053
O 5.882990 1.833270 1.358804
N -5.632802 0.128078 1.424462
C -3.718108 -1.124225 0.299956
C -4.248301 0.194994 0.908248
C -2.263534 -1.019573 -0.057313
C -1.280930 -1.333999 0.893041
C -1.886512 -0.600461 -1.344424
C 0.450981 -0.809865 -0.723259
C -0.537320 -0.487335 -1.674254
C 0.071221 -1.235815 0.560652
C -4.262110 1.269911 -0.181918
C 2.719380 -0.090006 -0.423536
C 2.437807 1.093160 0.262913
C 4.013561 -0.630943 -0.527899
C 3.493482 1.768693 0.882381
C 5.063511 0.045245 0.079755
C 4.785576 1.236038 0.780771
H -4.319078 -1.398919 -0.596025
H -3.881467 -1.954555 1.018070
H -3.571747 0.531707 1.744879
H -1.573496 -1.662686 1.893148
H -2.656164 -0.353575 -2.084780
H -5.690923 -0.455184 2.252951
H -6.280623 -0.236272 0.729486
H 1.422868 1.482449 0.317270
H 4.170366 -1.558045 -1.079077
H 3.307284 2.689037 1.427901
H 6.087501 -0.322289 0.030054
H -3.482655 3.073736 -0.452441
H 5.644148 2.666716 1.831933


%chk=000275301-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000275301

0 1
Br 0.401282 0.044543 -3.099888
Br 1.050173 -2.564321 2.055601
O 1.872452 -1.350540 -0.716139
O -2.882725 2.200545 0.644719
O -4.478896 1.765930 -0.984362
O 5.679148 2.503379 0.853882
N -5.714455 0.302820 1.207064
C -3.833599 -1.071240 0.150636
C -4.278318 0.229298 0.932645
C -2.337062 -1.159463 -0.086259
C -1.486522 -1.724607 0.897142
C -1.761081 -0.635785 -1.271677
C 0.498946 -1.220119 -0.474369
C -0.365762 -0.667752 -1.453996
C -0.093405 -1.752870 0.699384
C -3.922167 1.456455 0.093401
C 2.762125 -0.320623 -0.278570
C 2.335089 0.851024 0.377266
C 4.128398 -0.548174 -0.551758
C 3.297235 1.811278 0.766151
C 5.082888 0.409257 -0.164074
C 4.667355 1.590680 0.495794
H -4.387087 -1.083167 -0.806665
H -4.182175 -1.931108 0.752690
H -3.721292 0.283207 1.883085
H -1.910664 -2.151403 1.811590
H -2.401612 -0.210119 -2.050715
H -6.071843 -0.352122 1.903710
H -6.307221 0.418736 0.381383
H 1.274907 1.022735 0.587770
H 4.424183 -1.468803 -1.062663
H 2.970279 2.725015 1.278783
H 6.147693 0.259238 -0.362879
H -2.679452 2.977081 0.052938
H 5.295584 3.292696 1.309881


