%chk=000161426.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000161426

0 1
 Br -4.3000001E-03  -2.981700       2.060900    
 P    3.522300      -1.277700     -0.9905000    
 O   0.2457000       1.604200       1.282500    
 O    2.271200      -1.084500      2.2299999E-02
 O    3.250200       1.086200       1.331700    
 O  -0.2143000       4.074600      3.8300000E-02
 O    2.826000      -1.357000      -2.447800    
 O    3.982700      -2.803200     -0.7148000    
 O    4.610000     -0.2528000     -0.8539000    
 N  -0.7630000     -0.4802000      0.7648000    
 N   -2.317400      -2.080700      0.6816000    
 N   -1.926300       1.286800     -0.4301000    
 N   -4.145400      0.5654000      -1.145100    
 N   -4.994100      -1.624500     -0.6873000    
 C    1.529800      0.1168000     -3.9299998E-02
 C   0.4930000      0.2010000       1.070400    
 C    2.369900       1.347800      0.2388000    
 C    1.321700       2.363000      0.6836000    
 C   0.7521000       3.173200     -0.4724000    
 C   -1.824600      5.3199999E-02  8.6900003E-02
 C   -1.109500      -1.764600       1.099800    
 C   -2.776000     -0.9537000      4.6900000E-02
 C   -3.973400     -0.6623000     -0.5988000    
 C   -3.126200       1.450600      -1.028600    
 H    1.052300      0.1969000      -1.023500    
 H   0.8665000     -0.2049000       2.016800    
 H    2.967400       1.682400     -0.6133000    
 H    1.698700       3.037400       1.460700    
 H   0.2708000       2.546900      -1.228400    
 H    1.537900       3.757900     -0.9604000    
 H    3.738100       1.907500       1.513800    
 H  -0.9088000       3.546300      0.4676000    
 H   -3.297900       2.423400      -1.477000    
 H    3.396600      -1.398900      -3.244600    
 H    4.795800      -3.139200      -1.148700    
 H   -4.868100      -2.541700     -0.2812000    
 H   -5.854800      -1.388900      -1.162400    


%chk=000161426-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000161426

0 1
Br -0.005618 -2.877539 2.281981
P 3.658131 -1.245628 -1.069730
O 0.324690 1.595032 1.445170
O 2.177136 -1.041636 -0.248151
O 3.374230 1.198939 1.245286
O -0.682104 3.690929 -0.049067
O 3.189997 -1.002753 -2.689063
O 3.857875 -2.935417 -1.021076
O 4.881684 -0.374797 -0.531384
N -0.730654 -0.446779 0.815589
N -2.357538 -2.080014 0.832571
N -1.987796 1.294625 -0.488364
N -4.218684 0.521895 -1.162892
N -5.052248 -1.612070 -0.588838
C 1.511511 0.273567 -0.149946
C 0.560858 0.208390 1.069941
C 2.408516 1.505289 0.206101
C 1.343180 2.470976 0.762171
C 0.669783 3.308233 -0.368179
C -1.828001 0.074271 0.102483
C -1.133452 -1.737466 1.230588
C -2.808275 -0.952887 0.121663
C -4.041717 -0.695556 -0.544200
C -3.207444 1.431629 -1.098961
H 0.954152 0.453269 -1.086120
H 1.061438 -0.345223 1.885443
H 2.896550 1.917115 -0.701534
H 1.764761 3.108346 1.554156
H 0.706847 2.738898 -1.328145
H 1.249539 4.239063 -0.506925
H 4.160308 0.743149 0.821451
H -1.225297 2.831291 -0.076398
H -3.391972 2.393679 -1.585379
H 3.912151 -1.043186 -3.365974
H 4.259725 -3.295966 -0.189852
H -4.942616 -2.515383 -0.132015
H -5.915045 -1.371284 -1.073100


