%chk=000289814.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000289814

0 1
Br -2.228665 -3.735761 0.792184
Cl 1.135404 4.707163 0.134586
Cl -4.002004 3.887583 1.400353
Cl 4.663967 -3.014791 -1.965559
Cl 7.157310 -1.414519 -1.030026
O -2.026934 -1.229674 2.579783
O -4.346136 -2.282236 -0.770089
O -1.975927 -0.811006 -1.829859
O -4.199639 -0.400336 0.492195
O -0.359671 -2.285847 -1.231596
N 1.409822 1.782247 0.337993
C -0.610591 -0.044403 1.065362
C -0.935463 1.348192 0.973900
C -2.255342 -1.856187 0.261835
C -1.660327 -1.038200 1.458090
C 0.130802 2.231229 0.621479
C 0.665398 -0.481952 0.814815
C 1.666171 0.475473 0.419155
C -2.239126 1.875222 1.209339
C 3.027516 0.008859 0.062829
C -0.138902 3.641933 0.541779
C -3.700485 -1.399320 0.033480
C -1.398473 -1.721885 -0.999438
C -2.439532 3.230478 1.115465
C -1.394890 4.139814 0.785052
C 3.178381 -1.161018 -0.700779
C 4.155183 0.739278 0.473144
C 4.463225 -1.591289 -1.034284
C 5.438182 0.299639 0.137909
C 5.588327 -0.867759 -0.615050
C -5.765344 -2.019186 -1.071691
C -1.275089 -0.467623 -3.080554
C -6.612562 -2.370672 0.128507
C -0.143272 0.486053 -2.780652
H 0.938297 -1.539869 0.890648
H -3.070309 1.196274 1.450749
H -1.606006 5.211194 0.729359
H 2.305784 -1.730271 -1.040160
H 4.025100 1.660361 1.048617
H 6.316852 0.863259 0.457256
H -5.864673 -0.964156 -1.381254
H -5.905108 -2.703728 -1.929601
H -0.941414 -1.404985 -3.559394
H -2.106790 -0.004743 -3.644748
H -7.681817 -2.362898 -0.117546
H -6.368916 -3.368856 0.518951
H -6.461276 -1.657284 0.953854
H 0.272914 0.916109 -3.701965
H -0.470360 1.325874 -2.150753
H 0.685711 -0.010383 -2.255169


%chk=000289814-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000289814

0 1
Br -1.789294 -3.215849 1.207731
Cl 2.046614 4.874945 0.944197
Cl -3.382725 4.998002 1.935116
Cl 4.132404 -3.685000 -1.440795
Cl 6.944631 -2.029081 -1.037301
O -2.852894 -0.139543 2.113261
O -4.144012 -2.811818 -0.790551
O -2.134690 -0.468114 -1.900034
O -4.690323 -0.711924 0.066499
O -0.609848 -2.194303 -1.514481
N 1.617719 1.906866 0.636486
C -0.811174 0.449340 0.959457
C -0.825642 1.887677 1.127466
C -2.349203 -1.555919 0.186928
C -2.056784 -0.366043 1.174190
C 0.453526 2.563026 0.958687
C 0.392625 -0.193990 0.658053
C 1.599268 0.562304 0.478611
C -2.003727 2.640754 1.424180
C 2.881427 -0.094626 0.106841
C 0.480124 3.992124 1.127329
C -3.868679 -1.622697 -0.145272
C -1.569402 -1.487398 -1.153244
C -1.899341 4.021773 1.560201
C -0.667559 4.722701 1.422850
C 2.914410 -1.414018 -0.418727
C 4.101938 0.618313 0.256558
C 4.143739 -2.004261 -0.768064
C 5.326944 0.022829 -0.090642
C 5.352076 -1.293447 -0.602437
C -5.571430 -3.031697 -1.206149
C -1.528157 -0.185516 -3.249259
C -6.397370 -3.558903 -0.031702
C -0.343159 0.772276 -3.122222
H 0.428947 -1.283466 0.602512
H -2.963674 2.139197 1.558967
H -0.627987 5.807694 1.544541
H 1.998141 -1.986643 -0.594412
H 4.065385 1.640162 0.643107
H 6.267883 0.566690 0.031728
H -5.969470 -2.076728 -1.592261
H -5.480659 -3.767911 -2.019708
H -1.233185 -1.149490 -3.698826
H -2.367465 0.258267 -3.806573
H -7.416915 -3.805701 -0.381029
H -5.945104 -4.473539 0.387908
H -6.481643 -2.801747 0.765359
H 0.009530 1.048583 -4.132938
H -0.634946 1.697974 -2.597459
H 0.498434 0.303269 -2.586176


