%chk=000122301.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000122301

0 1
 Br -3.1599998E-02  -2.469100      -2.454000    
 P   -2.498100       1.649300      -1.563000    
 P   -4.052400     -0.2868000      1.8400000E-02
 P   -2.362100      -1.479200       2.121900    
 O   0.9589000       1.214700      0.9967000    
 O    2.537500       3.703800       1.546400    
 O    4.283400       2.202400      8.4899999E-02
 O   -1.386900       1.870300     -0.4077000    
 O    4.460800     -0.9724000       1.153300    
 O   -3.795900       1.094600     -0.7770000    
 O   -2.936600       3.146700      -1.990600    
 O   -2.055000      0.7833000      -2.706300    
 O    2.508800      -4.043500      -1.654600    
 O   -2.836400     -0.3377000       1.080900    
 O   -3.662200      -1.430200      -1.055600    
 O   -5.417400     -0.4315000      0.6243000    
 O   -1.878600      -2.679600       1.153400    
 O  -0.9783000     -0.8967000       2.719600    
 O   -3.392200      -1.860400       3.144100    
 N    2.425900     -0.4019000      0.1607000    
 N    3.471600      -2.493000     -0.2502000    
 C    2.070600       3.187300      0.3004000    
 C    2.901000       1.991800     -0.1167000    
 C   0.7034000       2.559600      0.5355000    
 C    2.341300      0.8940000      0.7715000    
 C  -0.1452000       2.475200     -0.7261000    
 C    3.519300      -1.260700      0.4115000    
 C    1.403100     -0.8033000     -0.6918000    
 C    1.364700      -1.983000      -1.321100    
 C    2.478600      -2.943900      -1.108800    
 H    2.078400       4.005900     -0.4237000    
 H    2.736200       1.769300      -1.177800    
 H   0.1422000       3.064400       1.330000    
 H    2.850500      0.8653000       1.742300    
 H   0.3365000       1.900400      -1.521100    
 H  -0.3375000       3.482900      -1.109400    
 H    2.438200       3.020600       2.230100    
 H    4.537600       2.986700     -0.4306000    
 H   0.5882000     -0.1131000     -0.8489000    
 H    4.249200      -3.125700     -8.3300002E-02
 H   -2.370100       3.647300      -2.615500    
 H   -4.303000      -1.655600      -1.763200    
 H   -1.623400      -3.538500       1.552400    
 H  -0.5291000      -1.385700       3.441500    


%chk=000122301-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000122301

0 1
Br 1.885603 -1.891250 -4.046566
P -1.809811 1.548268 -2.152251
P -2.505463 0.559426 0.851234
P -1.571305 -2.206202 1.993676
O 0.218029 1.460377 -0.088637
O 1.773771 3.631918 1.896419
O 3.605737 1.868703 1.244137
O -1.531862 3.140161 -1.554300
O 1.741607 -1.521143 2.001140
O -2.585495 0.665539 -0.862128
O -3.222473 1.773609 -3.063582
O -0.614713 0.875357 -2.937039
O 2.504736 -4.115408 -1.797411
O -1.318109 -0.729280 1.090580
O -3.988046 -0.198589 1.121933
O -2.195752 1.890460 1.632792
O -0.947538 -3.390277 0.924735
O -0.421430 -2.196639 3.183506
O -3.103907 -2.338763 2.416962
N 1.650655 -0.453749 -0.098307
N 2.138009 -2.747902 0.058156
C 1.771869 3.256756 0.490991
C 2.515196 1.905890 0.284756
C 0.308930 2.950987 0.088819
C 1.395314 0.855293 0.533898
C -0.142539 3.560474 -1.236809
C 1.829760 -1.576418 0.725093
C 1.637203 -0.570269 -1.497163
C 1.924248 -1.755196 -2.127049
C 2.224256 -2.973442 -1.359787
H 2.230543 4.054824 -0.127687
H 2.883498 1.816871 -0.757842
H -0.372836 3.222785 0.912574
H 1.243556 0.681567 1.613338
H 0.526890 3.277279 -2.071384
H -0.217024 4.657129 -1.159716
H 2.664206 3.392925 2.271939
H 4.125921 1.031297 1.176218
H 1.288019 0.309529 -2.045839
H 2.247208 -3.583035 0.644808
H -4.047285 1.453128 -2.613666
H -3.935432 -1.040151 1.713670
H -1.547165 -3.682508 0.191339
H 0.537321 -1.946029 2.857250


