%chk=000245488.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000245488

0 1
Br -7.010804 0.518865 0.125592
Br 5.737248 -3.264065 0.130485
Br 4.381167 4.033941 -0.465807
N 3.144573 0.044250 0.225031
C -0.507292 0.640144 0.282545
C -1.657970 1.573126 0.589305
C -1.003474 -0.622607 -0.166151
C -2.871298 0.730191 0.273238
C -2.466567 -0.570584 -0.173348
C 1.755564 -0.151975 0.045970
C 0.846091 0.888867 0.388069
C -0.113543 -1.633514 -0.502286
C 1.261931 -1.399802 -0.399326
C 4.115360 -0.941043 -0.321076
C 3.685216 1.406176 0.450679
C -4.209545 1.066450 0.366720
C -3.414515 -1.521218 -0.521451
C -5.149213 0.083521 0.007188
C -4.778383 -1.184663 -0.428286
C 4.473336 -1.920270 0.799281
C 3.696174 2.235874 -0.835775
H -1.649563 1.903322 1.646266
H -1.621108 2.491676 -0.027577
H 1.201168 1.852815 0.740724
H -0.476236 -2.602213 -0.844827
H 1.944953 -2.202756 -0.666538
H 3.691448 -1.484461 -1.199743
H 5.029561 -0.426122 -0.695414
H 3.075193 1.911369 1.239807
H 4.713434 1.317979 0.873684
H -4.526704 2.051473 0.704787
H -3.119376 -2.511245 -0.861040
H -5.531937 -1.925023 -0.699586
H 4.948721 -1.413379 1.657027
H 3.584966 -2.457075 1.180032
H 4.339597 1.793649 -1.615230
H 2.682326 2.349525 -1.262767


%chk=000245488-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000245488

0 1
Br -7.128617 0.486018 0.236620
Br 5.688613 -3.386948 0.259754
Br 4.517414 4.160046 -0.073385
N 3.182809 0.084037 -0.012551
C -0.520055 0.649132 0.182354
C -1.676171 1.601786 0.474271
C -1.028112 -0.631376 -0.189284
C -2.903321 0.727394 0.235033
C -2.498436 -0.586745 -0.156548
C 1.785040 -0.142694 -0.072172
C 0.856398 0.902477 0.238652
C -0.121550 -1.665384 -0.504661
C 1.265035 -1.424776 -0.442976
C 4.148424 -0.965196 -0.384023
C 3.733177 1.372631 0.441958
C -4.262600 1.061336 0.354727
C -3.469487 -1.574987 -0.431801
C -5.215255 0.054099 0.075043
C -4.841755 -1.251135 -0.314482
C 4.404589 -1.910058 0.807066
C 3.808081 2.372123 -0.729600
H -1.641926 1.988221 1.511664
H -1.663856 2.485670 -0.193177
H 1.205366 1.901861 0.516081
H -0.478590 -2.660607 -0.792227
H 1.942873 -2.249255 -0.681398
H 3.792287 -1.537760 -1.258139
H 5.099542 -0.492369 -0.685802
H 3.128348 1.791952 1.265150
H 4.747145 1.211355 0.848719
H -4.582044 2.064104 0.654125
H -3.179568 -2.587306 -0.733193
H -5.608852 -2.002410 -0.522312
H 4.891042 -1.398469 1.651339
H 3.491894 -2.423330 1.142956
H 4.510726 2.048842 -1.512485
H 2.821892 2.588919 -1.165095


