%chk=000001916.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000001916

0 1
 Br   2.061900       3.789400       1.140700    
 P   -5.016300     -0.8321000      0.8701000    
 O  -0.8375000      0.2183000      0.4203000    
 O   -1.132700       2.942000      -1.388200    
 O  -0.3347000     -0.3638000      -2.498100    
 O   -3.591900     -6.6699997E-02  0.9379000    
 O   -4.864200      -1.814300     -0.4055000    
 O   -6.018600      0.3191000      0.3357000    
 O    5.426100     -0.8836000      0.7183000    
 O   -5.439700      -1.498600       2.146400    
 N    1.368900       1.073000      0.3182000    
 N    1.501600      -1.291200     -0.2385000    
 N    3.527800       1.368200      0.8624000    
 N    3.692200      -2.245100      3.1999999E-03
 N    1.848100      -3.525600     -0.7163000    
 C  -0.3521000       1.750700      -1.366600    
 C  -4.5600001E-02   1.369600      8.1900001E-02
 C   -1.189200      0.5996000      -1.886600    
 C   -1.785700     -2.4000000E-02 -0.6322000    
 C   -3.121000      0.5889000     -0.2282000    
 C    1.996000     -0.1167000      0.1608000    
 C    2.344300       1.946800      0.7469000    
 C    3.305900      7.1300000E-02  0.4931000    
 C    4.245600      -1.029900      0.4252000    
 C    2.411000      -2.345200     -0.3013000    
 H   0.5458000       1.929400      -1.967800    
 H  -0.3317000       2.156700      0.7870000    
 H   -1.944700      0.8984000      -2.620000    
 H   -1.893700      -1.111300     -0.7170000    
 H   -3.841000      0.5101000      -1.049200    
 H   -3.015100       1.646900      3.0099999E-02
 H  -0.5873000       3.653200      -1.010700    
 H  -0.8931000      -1.102300      -2.795700    
 H   0.5294000      -1.437100     -0.4869000    
 H   0.8629000      -3.589200     -0.9483000    
 H    2.403700      -4.369500     -0.8043000    
 H   -5.590400      -2.440800     -0.6113000    
 H   -6.980000      0.1289000      0.2934000    


%chk=000001916-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000001916

0 1
Br 2.351334 3.817056 0.104159
P -4.871802 -1.323454 0.540529
O -0.805237 0.254112 0.355560
O -1.361758 3.280765 -0.776783
O -0.354737 0.347678 -2.638785
O -3.726237 -0.123191 0.939884
O -4.121830 -1.975968 -0.870160
O -6.185141 -0.518556 -0.254484
O 5.494073 -1.302044 -0.228392
O -5.263523 -2.275814 1.734926
N 1.440793 1.033494 0.115599
N 1.350627 -1.470120 0.214258
N 3.718294 1.254898 -0.067611
N 3.515431 -2.545752 0.051589
N 1.575553 -3.822477 0.339996
C -0.469126 2.174370 -1.110359
C 0.027119 1.454043 0.188185
C -1.312733 1.105864 -1.830993
C -1.882959 0.249015 -0.676934
C -3.195518 0.796715 -0.104926
C 1.986463 -0.249381 0.096832
C 2.565892 1.894355 0.019403
C 3.380020 -0.115124 -0.024976
C 4.243535 -1.314502 -0.082604
C 2.199426 -2.595941 0.197909
H 0.371157 2.485178 -1.753705
H -0.107213 2.109870 1.068936
H -2.098422 1.579898 -2.448308
H -2.027873 -0.803911 -0.973739
H -3.942637 0.929732 -0.911005
H -3.042310 1.753511 0.416142
H -0.820558 4.065963 -0.507588
H -0.827047 -0.326354 -3.188715
H 0.337255 -1.487559 0.356254
H 0.583606 -3.928689 0.534093
H 2.186359 -4.635724 0.346384
H -4.688179 -2.589875 -1.402849
H -6.957097 -0.308580 0.331177


