%chk=000198020.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000198020

0 1
Br 4.919742 -1.307257 -0.330014
F -4.230868 -1.670368 -0.269237
O -2.884112 0.132975 1.517007
N -1.763193 0.872938 -0.364723
C -0.673743 1.531206 0.380651
C 0.675404 0.846340 0.190680
C 0.812286 -0.544873 0.431006
C 1.815083 1.586929 -0.203275
C 2.060066 -1.186859 0.280702
C 3.074541 0.961463 -0.357516
C 3.178877 -0.422167 -0.114216
C -2.802224 0.227368 0.279274
C -3.882340 -0.318518 -0.663472
H -0.981915 1.496479 1.442535
H -0.608151 2.593735 0.079851
H -0.058619 -1.130227 0.747217
H 1.729930 2.664042 -0.392150
H -1.692013 0.831510 -1.383605
H 2.159757 -2.258980 0.472209
H 3.950433 1.541101 -0.662222
H -3.547072 -0.359767 -1.717224
H -4.796871 0.295629 -0.574480


%chk=000198020-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000198020

0 1
Br 4.860362 -1.480248 -0.047264
F -3.503049 -0.290141 -2.038105
O -2.973088 0.376810 1.513555
N -1.753744 0.878694 -0.428198
C -0.653046 1.581238 0.255099
C 0.677256 0.840657 0.166385
C 0.794788 -0.482693 0.663244
C 1.818401 1.462864 -0.392857
C 2.023692 -1.173866 0.604125
C 3.059447 0.787103 -0.460841
C 3.144152 -0.526732 0.039846
C -2.817150 0.341876 0.254199
C -3.874230 -0.338935 -0.618042
H -0.972132 1.683374 1.309003
H -0.551441 2.597707 -0.168856
H -0.078259 -0.974372 1.107426
H 1.748729 2.485982 -0.781712
H -1.728043 0.752201 -1.443833
H 2.108570 -2.192529 0.993139
H 3.936408 1.275390 -0.895016
H -4.842191 0.179008 -0.507773
H -3.970436 -1.400687 -0.334528


