%chk=000211690.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000211690

0 1
Br 5.946863 -1.463749 0.202077
Cl 4.972034 1.283973 -1.371442
S -2.053299 1.820177 0.196885
S 0.628704 2.778899 1.089665
O -0.673148 -1.612168 -0.909633
N 0.094895 0.393659 -0.037150
C -2.290989 0.178353 -0.562320
C -3.326934 -0.626507 0.214828
C -4.747604 -0.085505 0.011409
C -0.932040 -0.494866 -0.549885
C -5.779505 -0.962066 0.736655
C -0.303317 1.648748 0.427920
C 1.486403 -0.027143 0.010193
C -7.197670 -0.431836 0.543941
C 2.464811 0.741870 -0.634736
C 1.822162 -1.209797 0.690155
C 3.797258 0.317681 -0.577021
C 3.155555 -1.618597 0.730123
C 4.148316 -0.855750 0.101617
H -2.617194 0.314511 -1.627155
H -3.080376 -0.646719 1.297230
H -3.280322 -1.689093 -0.118606
H -4.822653 0.956055 0.382783
H -4.991728 -0.040248 -1.068012
H -5.542668 -1.008606 1.818276
H -5.717766 -2.005066 0.367543
H -7.483406 -0.408812 -0.514043
H -7.307719 0.586245 0.935568
H -7.928859 -1.061344 1.064961
H 2.203802 1.659878 -1.168415
H 1.049694 -1.811629 1.171359
H 3.420298 -2.539650 1.257333


%chk=000211690-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000211690

0 1
Br 5.974737 -1.568267 0.230321
Cl 5.075148 1.231035 -1.459983
S -2.080852 1.956977 0.152164
S 0.663392 2.872313 1.183189
O -0.658968 -1.563212 -1.030464
N 0.105488 0.447282 -0.044691
C -2.285589 0.222777 -0.604842
C -3.323388 -0.637501 0.148948
C -4.765190 -0.103644 0.012670
C -0.893310 -0.410258 -0.601225
C -5.792920 -0.990964 0.751419
C -0.297308 1.716083 0.435035
C 1.480661 -0.004796 0.027365
C -7.240864 -0.478896 0.597385
C 2.486501 0.721300 -0.643082
C 1.793377 -1.180823 0.741187
C 3.817808 0.266492 -0.587116
C 3.127964 -1.629812 0.786611
C 4.147889 -0.908265 0.127018
H -2.599564 0.360759 -1.655431
H -3.039883 -0.701935 1.217306
H -3.261250 -1.661646 -0.270174
H -4.823266 0.930094 0.411744
H -5.036495 -0.045015 -1.062171
H -5.527838 -1.038297 1.826946
H -5.723231 -2.028499 0.366182
H -7.542304 -0.453577 -0.466664
H -7.345951 0.545672 1.000857
H -7.955647 -1.127850 1.134927
H 2.243934 1.630379 -1.198041
H 1.008489 -1.746823 1.248892
H 3.382029 -2.540184 1.335821


