%chk=000175919.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000175919

0 1
 Br  0.5261000      -4.713400      -1.044900    
 Cl   2.232600     -0.2004000       2.718100    
 S   -1.688200      -2.546500     -0.3317000    
 O   -1.462700       3.300200      -1.149800    
 N   -2.298200      1.1700000E-02  0.1203000    
 N   0.1061000       1.754500     -0.6266000    
 N   -3.409100       1.916500      0.2515000    
 N   -4.261500      0.9093000      0.6089000    
 C   0.6628000      0.6938000      0.2069000    
 C   7.4500002E-02 -0.6515000     -0.1412000    
 C   -1.282400     -0.9173000     -9.7199999E-02
 C    2.174000      0.6238000      0.1211000    
 C   -2.237700       1.387800     -5.1800001E-02
 C   0.7757000      -1.876200     -0.4499000    
 C   -1.201100       2.210800     -0.6339000    
 C   -3.601300     -0.2174000      0.5019000    
 C  -5.7300001E-02  -2.964500     -0.5917000    
 C    2.953600      0.2296000       1.210000    
 C    2.787500      0.9653000      -1.085300    
 C   -4.266300      -1.524600      0.6892000    
 C    4.342500      0.1770000       1.092400    
 C    4.176500      0.9128000      -1.202600    
 C    4.954000      0.5187000     -0.1138000    
 H   0.3579000      0.9611000       1.225900    
 H   0.7585000       2.401100      -1.059300    
 H    1.850400      -1.961600     -0.5532000    
 H    2.218800       1.241100      -1.968600    
 H   -3.763700      -2.143700       1.437400    
 H   -5.278600      -1.360000       1.079900    
 H   -4.399600      -2.059500     -0.2550000    
 H    4.962700     -0.1288000       1.931200    
 H    4.652500       1.170100      -2.144300    
 H    6.035300      0.4758000     -0.2060000    


%chk=000175919-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000175919

0 1
Br 0.415000 -4.581301 -2.109835
Cl 1.892757 0.322184 2.964049
S -1.861520 -2.532904 -1.108742
O -1.457027 3.189564 -1.603067
N -2.328145 0.014064 0.047280
N 0.113822 1.693509 -0.788668
N -3.345398 2.012791 0.365433
N -4.144012 0.997219 0.952402
C 0.572223 0.585562 0.093383
C -0.008426 -0.743742 -0.402128
C -1.382717 -0.940953 -0.374370
C 2.094314 0.578177 0.162692
C -2.258997 1.419288 -0.172212
C 0.712752 -1.857898 -0.964134
C -1.190886 2.164337 -0.913923
C -3.532633 -0.190710 0.752486
C -0.111253 -2.887488 -1.375798
C 2.800810 0.471222 1.383692
C 2.868934 0.664675 -1.026396
C -4.050519 -1.509212 1.227644
C 4.208488 0.468808 1.445940
C 4.278472 0.668145 -0.990227
C 4.951050 0.572107 0.249501
H 0.175838 0.766023 1.112263
H 0.817905 2.257627 -1.273428
H 1.800648 -1.898074 -1.030654
H 2.354205 0.722176 -1.993523
H -3.279548 -2.084034 1.770807
H -4.894857 -1.312361 1.906003
H -4.420904 -2.139763 0.398638
H 4.711432 0.389599 2.413814
H 4.847558 0.741499 -1.922301
H 6.044935 0.575461 0.291282


