%chk=000044483.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000044483

0 1
 Br  -7.940800     -0.4677000     -3.7200000E-02
 O    5.204400       1.772400      0.1346000    
 O    5.313500      -1.750500     -0.1994000    
 N    4.627000      0.4772000      2.5500000E-02
 C   0.4969000     -0.1987000      6.2100001E-02
 C    3.250000      0.2513000      3.6699999E-02
 C    1.003100      0.9980000     -0.4445000    
 C    1.367100      -1.170600      0.5561000    
 C    2.379700       1.223100     -0.4574000    
 C    2.743600     -0.9457000      0.5433000    
 C  -0.9384000     -0.4336000      7.5099997E-02
 C   -3.341800      0.2887000     -1.0600000E-02
 C   -1.887900      0.5286000     -4.3000001E-03
 C   -3.820500     -0.9669000     -0.3477000    
 C   -4.201500       1.323800      0.3192000    
 C    5.572700     -0.5517000     -9.4499998E-02
 C   -5.196900      -1.193400     -0.3554000    
 C   -5.577900       1.097300      0.3116000    
 C   -6.075600     -0.1615000     -2.5599999E-02
 C    7.023400     -0.1201000     -8.8000000E-02
 H   0.3676000       1.774000     -0.8610000    
 H   0.9896000      -2.103600      0.9683000    
 H    2.756900       2.157900     -0.8642000    
 H    3.369400      -1.707900      0.9950000    
 H   -1.220000      -1.478300      0.1761000    
 H   -1.611300       1.578400     -5.2600000E-02
 H   -3.176000      -1.792000     -0.6332000    
 H   -3.829500       2.309600      0.5854000    
 H   -5.569200      -2.178300     -0.6255000    
 H   -6.249000       1.912000      0.5711000    
 H    7.217900      0.5580000     -0.9235000    
 H    7.264900      0.3707000      0.8588000    
 H    7.667900     -0.9975000     -0.1976000    
 H    5.174100       1.889200       1.099900    


%chk=000044483-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000044483

0 1
Br -8.169259 -0.355510 -0.018005
O 5.165327 1.746540 0.152971
O 5.552525 -1.808387 -0.235643
N 4.752340 0.351065 0.114881
C 0.487645 -0.204417 0.059690
C 3.335514 0.136572 0.073793
C 1.078658 1.086887 -0.063139
C 1.374571 -1.312819 0.177824
C 2.471416 1.260299 -0.058413
C 2.772569 -1.165329 0.187742
C -0.960676 -0.444703 0.063519
C -3.401880 0.252457 -0.015162
C -1.952802 0.499103 -0.016972
C -3.981776 -1.048821 0.065767
C -4.289619 1.364569 -0.098145
C 5.798327 -0.576555 -0.089144
C -5.377670 -1.231803 0.065401
C -5.690300 1.200427 -0.099936
C -6.221884 -0.102283 -0.017316
C 7.203889 0.002146 -0.102607
H 0.444784 1.972867 -0.176495
H 0.955250 -2.322766 0.265845
H 2.900985 2.256669 -0.186945
H 3.427472 -2.033299 0.263392
H -1.247494 -1.503288 0.141376
H -1.667422 1.558279 -0.089786
H -3.341478 -1.934825 0.129126
H -3.874959 2.377884 -0.162616
H -5.804101 -2.237105 0.127916
H -6.351857 2.068860 -0.164412
H 7.310444 0.781112 -0.875887
H 7.460935 0.467994 0.865862
H 7.901400 -0.824881 -0.300978
H 5.092525 2.015262 1.113093


