%chk=000289298.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000289298

0 1
Br 3.305508 2.020111 0.618224
O -1.673806 0.343692 1.489343
N -1.854832 -0.305557 -0.694508
C -2.814529 -1.199106 0.031049
C -0.244348 1.570412 -0.035848
C -1.273849 0.492281 0.147300
C -2.669307 -0.729058 1.525795
C 0.753740 1.177549 -1.144676
C -0.948752 2.901567 -0.376631
C -2.385364 -2.657405 -0.140067
C -4.231659 -0.967838 -0.494463
C 1.651395 0.052561 -0.714694
C -1.712314 3.460303 0.819262
C 2.809648 0.258107 0.047733
C 1.330693 -1.265972 -1.086185
C 3.639696 -0.801250 0.424885
C 2.150757 -2.331936 -0.715617
C 3.307662 -2.101729 0.037672
H 0.310305 1.691131 0.935666
H -3.576380 -0.278790 1.947694
H -2.258935 -1.490782 2.200897
H 1.353113 2.064971 -1.440777
H 0.193756 0.894727 -2.064954
H -1.635117 2.754687 -1.234936
H -0.192875 3.638839 -0.713740
H -3.056692 -3.341896 0.386544
H -2.387200 -2.938254 -1.202307
H -1.365417 -2.826486 0.226703
H -4.545772 0.076014 -0.374374
H -4.284042 -1.184585 -1.570862
H -4.961696 -1.606573 0.010777
H -1.034526 3.778532 1.620424
H -2.387269 2.709215 1.254614
H -2.318825 4.326775 0.535043
H 0.419003 -1.449818 -1.662267
H 4.538457 -0.621010 1.016198
H 1.889589 -3.346551 -1.013929
H 3.948883 -2.933380 0.324411


%chk=000289298-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000289298

0 1
Br 3.393936 1.999853 0.718590
O -1.522072 0.269487 1.614646
N -1.855231 -0.219021 -0.638713
C -2.786600 -1.161559 0.095640
C -0.237057 1.616399 -0.017565
C -1.231811 0.509778 0.244317
C -2.510544 -0.858739 1.617110
C 0.789390 1.187979 -1.113900
C -0.967798 2.923678 -0.448815
C -2.429410 -2.616066 -0.277149
C -4.240843 -0.826481 -0.303932
C 1.691274 0.039581 -0.697772
C -1.965965 3.457937 0.598844
C 2.851955 0.200244 0.101217
C 1.384066 -1.288332 -1.107155
C 3.673007 -0.880203 0.484524
C 2.187520 -2.387794 -0.737891
C 3.335395 -2.185417 0.060932
H 0.297877 1.811502 0.930737
H -3.404290 -0.513694 2.163416
H -2.040819 -1.704051 2.148330
H 1.399565 2.076439 -1.361433
H 0.220951 0.901817 -2.016591
H -1.489315 2.734550 -1.407511
H -0.192553 3.690815 -0.644957
H -3.091750 -3.329156 0.248613
H -2.546933 -2.768505 -1.364292
H -1.382432 -2.842875 -0.007223
H -4.494861 0.213086 -0.028733
H -4.367504 -0.930829 -1.395361
H -4.952518 -1.507840 0.199108
H -1.464397 3.652982 1.564589
H -2.778945 2.733860 0.787445
H -2.425304 4.402450 0.254576
H 0.488409 -1.437110 -1.720483
H 4.561094 -0.706863 1.099058
H 1.922714 -3.395691 -1.075526
H 3.970495 -3.028712 0.352712


