%chk=000251274.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000251274

0 1
Br -0.415583 -0.029758 3.045649
O -2.750424 -0.765587 -1.413976
O 0.114138 0.625584 -2.901286
O 1.750187 0.109317 0.245701
O 0.435383 -1.738514 0.183216
C -3.761025 0.218929 0.448943
C -2.420852 -0.284460 -0.084570
C -3.665378 0.632862 1.921168
C -1.616708 -1.028157 -2.257709
C -1.268879 0.243856 -3.036766
C -4.996267 1.174847 2.437819
C 0.517784 1.103305 -1.603914
C 1.714975 0.236227 -1.208428
C 1.048108 -0.919864 0.822459
C 1.203714 -0.815369 2.312506
H -4.116720 1.062657 -0.174049
H -4.524380 -0.575837 0.316427
H -2.012668 -1.134429 0.492517
H -1.656612 0.516319 -0.153530
H -3.357956 -0.237934 2.534663
H -2.878325 1.402457 2.046370
H -1.999901 -1.828269 -2.918561
H -0.758112 -1.421887 -1.680667
H -1.330368 0.098241 -4.132647
H -1.924789 1.082879 -2.742808
H -5.794931 0.428108 2.354349
H -4.925959 1.463078 3.492414
H -5.318561 2.059082 1.875799
H -0.301712 1.040984 -0.855245
H 0.793090 2.161948 -1.757188
H 1.665022 -0.763541 -1.681774
H 2.690421 0.710390 -1.414826
H 2.065103 -0.176938 2.601148
H 1.346586 -1.818226 2.765295


%chk=000251274-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000251274

0 1
Br 3.802593 0.895590 2.551238
O -3.014155 -0.321705 -1.292445
O 0.354726 0.754516 -2.690582
O 2.886185 -0.832454 -0.393016
O 1.123271 -1.100730 1.120368
C -4.770195 0.135463 0.314157
C -3.300780 0.392151 -0.033645
C -5.212257 0.868250 1.602335
C -1.586202 -0.431548 -1.608048
C -1.043683 0.873471 -2.235313
C -6.693050 0.605380 1.951750
C 1.347662 0.698909 -1.610670
C 1.895432 -0.738502 -1.511395
C 2.347642 -0.983422 0.881666
C 3.449096 -0.998449 1.920715
H -5.398555 0.460480 -0.537868
H -4.923295 -0.955144 0.426177
H -2.631085 0.013545 0.771047
H -3.117473 1.482736 -0.152129
H -4.570960 0.548373 2.448946
H -5.049348 1.958944 1.481722
H -1.508988 -1.251590 -2.343216
H -1.011394 -0.704895 -0.696302
H -1.615875 1.111747 -3.146902
H -1.136368 1.720900 -1.523501
H -6.876689 -0.473845 2.110044
H -6.990968 1.138423 2.873185
H -7.358591 0.942113 1.134816
H 0.908049 1.009009 -0.641911
H 2.160510 1.398030 -1.875537
H 1.081129 -1.460338 -1.333471
H 2.467569 -1.014566 -2.408825
H 4.401837 -1.357240 1.510801
H 3.132610 -1.551301 2.814309


