%chk=000270994.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000270994

0 1
Br 2.850024 2.857203 0.108527
Br 0.953303 -2.208152 0.708145
S 6.455768 -1.439717 -0.446988
O -2.070222 -2.126281 1.198901
O -1.061758 3.139385 -0.644522
O -1.305964 3.462251 1.590032
O 7.413454 -0.387887 -0.193285
O 6.579562 -2.750064 0.149264
N -3.295620 -0.340707 0.247295
N -3.105831 1.014669 0.057396
N 0.078613 -0.109919 0.521729
N 1.054753 0.628682 0.825135
N 6.451836 -1.683898 -2.144975
C -1.199539 0.212752 1.209212
C -1.954443 1.374867 0.574696
C -2.170392 -0.966166 0.916129
C -4.485409 -0.973230 -0.278684
C -1.425451 2.765376 0.612708
C -4.686165 -2.344374 -0.045666
C -5.425463 -0.218270 -1.003444
C 4.856517 -0.830372 -0.130808
C 2.319949 0.146995 0.365959
C 4.637025 0.551554 -0.164445
C 3.826906 -1.743940 0.148288
C 3.353880 1.043260 0.087949
C 2.552079 -1.246830 0.377295
C -5.839699 -2.953547 -0.545112
C -6.570501 -0.849757 -1.490917
C -6.782318 -2.214147 -1.265284
C -0.466879 4.484120 -0.791332
C 0.205866 4.427079 -2.143498
H -1.097541 0.365330 2.319472
H -3.958438 -2.937684 0.514051
H -5.268174 0.846281 -1.185024
H 5.463451 1.246548 -0.370238
H 4.025966 -2.823307 0.185132
H -6.001012 -4.017367 -0.367872
H -7.303930 -0.270736 -2.052716
H -7.678166 -2.697877 -1.649641
H -1.304270 5.200557 -0.740432
H 0.231334 4.651345 0.048008
H 7.043098 -1.090102 -2.723181
H 6.486792 -2.637601 -2.499677
H 0.685823 5.381384 -2.391268
H 0.973241 3.639378 -2.179802
H -0.514455 4.193815 -2.941212


%chk=000270994-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000270994

0 1
Br 3.495542 1.865096 2.112345
Br 1.218933 -2.853686 -0.544594
S 6.836462 -2.218914 -0.060482
O -1.867331 -1.696197 1.505375
O -1.804169 3.608823 -1.221767
O 0.035265 3.283296 0.190231
O 7.826295 -1.557701 1.048894
O 6.679772 -3.819500 -0.308926
N -3.019784 -0.158643 0.066058
N -2.798693 1.137715 -0.447326
N 0.364275 0.099776 0.286937
N 1.281811 -0.015565 1.188414
N 7.286859 -1.465486 -1.672278
C -0.926603 0.562675 0.891842
C -1.626494 1.562925 -0.000781
C -1.954006 -0.608140 0.898662
C -4.241876 -0.832052 -0.273511
C -1.044401 2.884716 -0.320888
C -4.496643 -2.143643 0.203255
C -5.187031 -0.164922 -1.094196
C 5.108295 -1.531080 0.254248
C 2.544633 -0.532723 0.747812
C 5.004189 -0.315394 0.944839
C 4.013217 -2.281520 -0.190832
C 3.706878 0.164035 1.192880
C 2.723220 -1.764977 0.049915
C -5.706414 -2.778595 -0.151139
C -6.388204 -0.817857 -1.435428
C -6.656642 -2.125862 -0.967871
C -1.265817 4.961207 -1.585940
C -2.231191 5.553144 -2.605494
H -0.766164 0.926163 1.925600
H -3.767964 -2.651717 0.837652
H -4.970372 0.843732 -1.452776
H 5.894302 0.215667 1.292920
H 4.160972 -3.244320 -0.688298
H -5.901771 -3.791173 0.217834
H -7.116267 -0.300786 -2.069701
H -7.592316 -2.627302 -1.236487
H -1.197208 5.562920 -0.661559
H -0.245651 4.826747 -1.988377
H 8.139358 -0.897180 -1.538254
H 7.397059 -2.220040 -2.369434
H -1.881553 6.556796 -2.908504
H -2.291202 4.918991 -3.505982
H -3.243975 5.651447 -2.179589


