%chk=000226970.chk
%nprocshared=4
%mem=3800MB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000226970

0 1
 Br  -6.587500     -3.7200000E-02  7.3000002E-03
 S    1.249700       1.516400     -8.9999998E-04
 O    4.570400     -0.6464000      3.9999999E-04
 O    4.226500       1.632000     -6.9999998E-04
 N   -1.440000       1.520900      3.9999999E-04
 N  -0.5645000     -0.5220000     -5.5000000E-03
 C   -2.510600      0.6639000      5.0000002E-04
 C   -1.937900     -0.6050000     -3.4000000E-03
 C  -0.3006000      0.7656000     -3.0000000E-03
 C   -3.888600      0.8829000      3.4000000E-03
 C   -2.774600      -1.733900     -4.4999998E-03
 C   -4.706300     -0.2518000      2.4999999E-03
 C   -4.161200      -1.537800     -1.5000000E-03
 C    2.350900      7.1000002E-02 -3.1000001E-03
 C    3.800900      0.4853000     -1.6000000E-03
 C    5.985600     -0.4314000      3.8999999E-03
 C    6.688000      -1.772500      5.7999999E-03
 H   -1.484400       2.531100      3.1000001E-03
 H   -4.295300       1.888600      6.5000001E-03
 H   -2.360700      -2.737200     -7.4999998E-03
 H   -4.808300      -2.412400     -2.2000000E-03
 H    2.158300     -0.5265000      0.8934000    
 H    2.159300     -0.5234000     -0.9018000    
 H    6.270900      0.1347000     -0.8898000    
 H    6.266600      0.1349000      0.8987000    
 H    7.774100      -1.645200      8.2999999E-03
 H    6.398300      -2.358000      0.8846000    
 H    6.402600      -2.358200     -0.8743000    


%chk=000226970-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000226970

0 1
Br -6.674988 -0.142481 -0.001068
S 1.305868 1.681695 0.001621
O 4.583202 -0.666525 0.001765
O 4.275724 1.648033 0.001522
N -1.484155 1.617114 0.001053
N -0.522734 -0.459504 -0.000188
C -2.553549 0.705616 0.000247
C -1.932463 -0.590540 -0.000529
C -0.301782 0.862823 0.000769
C -3.950149 0.884143 0.000122
C -2.735321 -1.751146 -0.001466
C -4.714181 -0.300085 -0.000824
C -4.138927 -1.598313 -0.001611
C 2.340130 0.103025 0.000635
C 3.808603 0.487544 0.001368
C 6.070002 -0.461959 0.002291
C 6.703402 -1.848029 0.002563
H -1.548123 2.633657 0.001717
H -4.424136 1.868772 0.000714
H -2.278311 -2.744643 -0.002069
H -4.787741 -2.478214 -0.002329
H 2.080042 -0.495045 0.887727
H 2.080581 -0.493489 -0.887675
H 6.333957 0.129085 -0.893045
H 6.333302 0.129137 0.897784
H 7.804462 -1.752994 0.002964
H 6.404114 -2.419612 0.897415
H 6.404771 -2.419665 -0.892474


