%chk=000293394.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000293394

0 1
Br 4.706009 -1.451261 -1.475895
O 2.481973 1.450521 0.197338
N 1.315642 -0.537464 0.567481
N 3.652664 -0.374587 0.978826
C -4.775199 -1.317445 -0.348717
C -5.140937 0.138248 -0.040685
C -3.453899 -1.696164 0.332090
C -4.070201 1.088802 -0.591478
C -2.374633 -0.662947 0.146174
C -2.669081 0.654054 -0.257706
C -1.049806 -1.031204 0.417875
C -1.623497 1.581596 -0.381776
C -0.015176 -0.085597 0.284435
C -0.302161 1.228945 -0.115569
C 2.472481 0.276258 0.528991
C 4.937805 0.313957 0.730315
C 5.301815 0.275134 -0.753750
H -4.686754 -1.458939 -1.443724
H -5.580559 -1.996592 -0.013821
H -5.240247 0.278464 1.053316
H -6.126796 0.387567 -0.474117
H -3.112377 -2.680830 -0.046103
H -3.621164 -1.832609 1.422582
H -4.254311 2.113196 -0.209079
H -4.163604 1.156541 -1.696772
H -0.831183 -2.048423 0.729727
H -1.842355 2.603462 -0.693626
H 0.498044 1.968920 -0.218471
H 1.399045 -1.510354 0.862942
H 3.697475 -1.389045 1.047634
H 4.852237 1.378333 1.067277
H 5.719322 -0.174624 1.353699
H 6.381911 0.377262 -0.936218
H 4.768019 1.059927 -1.325394


%chk=000293394-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000293394

0 1
Br 6.201548 -1.924765 -0.861573
O 2.484981 1.633931 0.207826
N 1.284992 -0.391272 0.450530
N 3.618337 -0.360589 0.652002
C -4.853884 -1.347954 -0.350300
C -5.267075 0.079405 0.071357
C -3.494399 -1.720280 0.282776
C -4.249866 1.109865 -0.466766
C -2.438798 -0.626497 0.121989
C -2.799679 0.712202 -0.201040
C -1.076418 -0.944152 0.327069
C -1.770078 1.681060 -0.296333
C -0.056880 0.035635 0.227261
C -0.411850 1.373480 -0.088419
C 2.451628 0.382022 0.416294
C 4.926134 0.290951 0.628653
C 5.717471 0.050154 -0.661185
H -4.780344 -1.393161 -1.455582
H -5.622048 -2.083516 -0.044794
H -5.308979 0.133326 1.177994
H -6.279480 0.319047 -0.305255
H -3.117724 -2.669703 -0.145405
H -3.647667 -1.910773 1.366194
H -4.447256 2.108780 -0.031690
H -4.399156 1.218221 -1.562136
H -0.807451 -1.982456 0.572021
H -2.040316 2.716656 -0.540195
H 0.365631 2.135479 -0.159285
H 1.387038 -1.381812 0.681695
H 3.601467 -1.381052 0.694179
H 4.734568 1.378967 0.706957
H 5.524810 -0.021839 1.503703
H 6.686064 0.572888 -0.658293
H 5.135179 0.290850 -1.562449


