%chk=000218315.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000218315

0 1
Br -6.014040 -0.779444 1.634692
Cl 2.332807 -3.547272 -1.732337
Cl 5.737439 1.039962 2.218068
O -0.318364 0.537024 -2.064356
N 2.615238 0.149063 -0.161676
N 0.425944 1.166344 0.007461
C 1.811732 1.369972 -0.486909
C 2.517088 -0.909459 -1.213019
C 4.024715 0.465024 0.219439
C 2.468047 -2.258580 -0.493187
C 4.052402 0.662566 1.737471
C -0.546649 0.651050 -0.872362
C -1.865049 0.324712 -0.240452
C -2.464234 -0.904305 -0.550980
C -2.508516 1.234101 0.608886
C -3.700852 -1.238284 0.008556
C -3.748221 0.908725 1.167342
C -4.325375 -0.326856 0.863480
H 2.230631 2.260388 0.041433
H 1.775500 1.600440 -1.582707
H 3.354265 -0.884122 -1.944285
H 1.586738 -0.768866 -1.820234
H 4.431865 1.361166 -0.299372
H 4.702718 -0.374523 -0.059374
H 0.349193 0.965420 1.004439
H 3.378206 -2.455697 0.101768
H 1.592464 -2.336213 0.177858
H 3.410275 1.497898 2.069315
H 3.737422 -0.250488 2.277284
H -1.968299 -1.594975 -1.238365
H -2.052541 2.201349 0.827820
H -4.167831 -2.196007 -0.229309
H -4.253619 1.616087 1.827011


%chk=000218315-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000218315

0 1
Br -5.890645 -0.030562 2.331164
Cl 3.358536 -3.523673 -2.083928
Cl 3.984877 0.755929 3.325940
O -0.244620 -0.680397 -1.737368
N 2.922870 0.382695 -0.688002
N 0.524518 1.090262 -0.449628
C 1.821569 1.196517 -1.175338
C 3.380227 -0.794995 -1.442344
C 3.623862 0.790246 0.532264
C 2.601530 -2.083436 -1.106149
C 3.107607 0.062076 1.792463
C -0.443929 0.161470 -0.801584
C -1.734392 0.176610 -0.022624
C -2.577521 -0.957022 -0.146592
C -2.153624 1.257226 0.796593
C -3.803425 -1.029440 0.544754
C -3.380089 1.202491 1.493316
C -4.189125 0.053946 1.363174
H 2.100607 2.269032 -1.135295
H 1.615359 0.913304 -2.221143
H 4.455265 -0.954346 -1.232032
H 3.287499 -0.606152 -2.529048
H 3.496997 1.881619 0.679314
H 4.710563 0.601312 0.433714
H 0.370424 1.702504 0.352614
H 2.691804 -2.371046 -0.047567
H 1.549838 -2.021491 -1.419724
H 2.032493 0.222918 1.961551
H 3.340689 -1.012975 1.785947
H -2.253431 -1.772919 -0.800368
H -1.557720 2.173505 0.883811
H -4.445437 -1.909194 0.447591
H -3.702077 2.040185 2.117923


