%chk=000261093.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000261093

0 1
Br 3.557348 2.489284 -1.385429
Br 4.813297 -2.632629 0.382133
Cl -6.960863 -1.142362 -1.727992
Cl -6.339481 2.180393 1.888557
O 5.804249 0.120082 1.598472
N -4.454189 0.105515 0.070497
N 5.218532 0.146972 -0.623560
C -0.817434 0.562963 -0.359401
C 0.331823 1.452900 -0.779324
C -0.323040 -0.701741 0.085184
C 1.537290 0.582720 -0.535515
C 1.134847 -0.698825 -0.019290
C -2.166005 0.851554 -0.370613
C -3.079111 -0.150801 0.074079
C -1.214501 -1.675494 0.520892
C 2.873838 0.853803 -0.726018
C -2.583886 -1.406025 0.514385
C 2.072298 -1.677646 0.284117
C 3.835632 -0.134516 -0.413696
C -5.436072 -0.907214 0.517851
C -5.003723 1.410455 -0.358472
C 3.425870 -1.380185 0.069029
C -5.787979 -1.891379 -0.599645
C -4.967877 2.446114 0.767562
C 6.145340 0.246890 0.443241
C 7.551116 0.522067 -0.011367
H 0.255982 1.765116 -1.839971
H 0.376126 2.387891 -0.184306
H -2.516539 1.816686 -0.718261
H -0.851188 -2.643427 0.866303
H -3.265956 -2.174708 0.864791
H 1.770673 -2.648325 0.676497
H -5.028147 -1.469514 1.394293
H -6.355569 -0.395759 0.895605
H -4.425753 1.793593 -1.235489
H -6.048528 1.270051 -0.731130
H -6.259321 -2.807811 -0.197612
H -4.899400 -2.184994 -1.193727
H -5.061779 3.475386 0.373437
H -4.036096 2.382823 1.364784
H 5.495601 0.363694 -1.581103
H 7.935945 -0.262952 -0.675856
H 8.222330 0.560868 0.863096
H 7.643799 1.485284 -0.529226


%chk=000261093-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000261093

0 1
Br 3.457313 2.617194 -1.358745
Br 4.735453 -2.857531 0.277286
Cl -6.755282 -1.207920 -2.002118
Cl -6.070966 2.163977 2.217310
O 5.881892 0.020297 1.649662
N -4.522038 0.117195 0.085622
N 5.284688 0.162734 -0.607859
C -0.830173 0.564542 -0.365759
C 0.327941 1.469552 -0.774650
C -0.332128 -0.705698 0.050262
C 1.541342 0.582604 -0.546145
C 1.132672 -0.699783 -0.059938
C -2.199425 0.852941 -0.357349
C -3.139155 -0.145099 0.068809
C -1.242670 -1.696243 0.474799
C 2.902048 0.843985 -0.717761
C -2.622340 -1.420693 0.479794
C 2.086735 -1.701130 0.216377
C 3.902711 -0.134710 -0.434693
C -5.487652 -0.907202 0.510197
C -5.052083 1.427694 -0.317945
C 3.449791 -1.411332 0.006102
C -5.802137 -1.970031 -0.552836
C -4.928700 2.525317 0.749709
C 6.206352 0.234914 0.451658
C 7.633633 0.555994 0.018657
H 0.255261 1.797215 -1.830177
H 0.378601 2.392596 -0.164691
H -2.536383 1.842461 -0.678782
H -0.892679 -2.681439 0.802880
H -3.301367 -2.209383 0.813505
H 1.786969 -2.691378 0.569016
H -5.117228 -1.429648 1.415675
H -6.419841 -0.405093 0.817054
H -4.535971 1.782551 -1.233399
H -6.110870 1.307047 -0.600157
H -6.462831 -2.756115 -0.154840
H -4.898945 -2.405499 -1.003351
H -5.256274 3.503287 0.363435
H -3.920837 2.590468 1.183419
H 5.585584 0.499514 -1.525260
H 8.210772 -0.384643 -0.046101
H 8.105633 1.186707 0.788071
H 7.692081 1.066582 -0.958947


