%chk=000241835.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000241835

0 1
Br -5.821383 -0.452900 -0.063175
Cl 2.894054 1.649801 1.912248
Cl 7.028539 -0.823992 -0.418528
S 0.422198 -1.261841 0.493290
N -3.715810 1.371207 -0.964602
N -1.761995 0.163125 -0.170119
N -2.072007 -2.066995 0.770739
C -3.144456 2.748673 -0.926459
C -4.472166 2.447429 -0.257842
C -3.121451 0.284772 -0.280702
C -3.986052 -0.753865 0.153000
C -1.307037 -1.020698 0.340325
C -3.422311 -1.923591 0.672770
C 1.123304 0.268628 -0.212363
C 2.589055 0.015387 -0.241416
C 3.475694 0.593000 0.682926
C 3.124299 -0.834917 -1.229300
C 4.851810 0.346615 0.644553
C 4.492386 -1.099231 -1.289523
C 5.338504 -0.503023 -0.348909
H -3.110648 3.261918 -1.893955
H -2.254794 2.965233 -0.327776
H -4.559274 2.446587 0.831491
H -5.416739 2.732521 -0.736830
H -4.036294 -2.766612 1.019620
H 0.819131 1.149497 0.389568
H 0.706304 0.458254 -1.225564
H 2.455517 -1.298756 -1.958909
H 5.524163 0.805058 1.372784
H 4.896762 -1.761385 -2.056344


%chk=000241835-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000241835

0 1
Br -6.037690 -0.472992 0.073768
Cl 2.675731 1.443915 2.086874
Cl 7.196599 -0.447613 -0.481473
S 0.334521 -1.505866 0.582330
N -3.581523 1.400579 -0.928645
N -1.832576 0.024879 -0.137476
N -2.253042 -2.125242 0.930557
C -2.902381 2.712591 -0.885365
C -4.352593 2.560876 -0.402939
C -3.180744 0.256166 -0.256189
C -4.107401 -0.715555 0.234738
C -1.440849 -1.146100 0.430463
C -3.593765 -1.885559 0.823663
C 1.058396 0.055058 -0.263350
C 2.559426 -0.057150 -0.293028
C 3.400728 0.515762 0.693389
C 3.200811 -0.765684 -1.345306
C 4.805697 0.411800 0.656106
C 4.602640 -0.896058 -1.419094
C 5.385017 -0.300190 -0.410601
H -2.705502 3.174790 -1.857362
H -2.116873 2.845148 -0.132473
H -4.534869 2.601397 0.677471
H -5.178443 2.904507 -1.032253
H -4.263178 -2.655781 1.219262
H 0.703541 0.919425 0.314785
H 0.622642 0.091098 -1.272699
H 2.578170 -1.227874 -2.119198
H 5.422719 0.869461 1.432818
H 5.074095 -1.445887 -2.237775


