%chk=000215635.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000215635

0 1
Br 5.892720 2.876900 0.966244
S 1.898185 -1.972194 -0.422209
O 2.038099 -2.971179 0.623455
O 2.112525 -2.322808 -1.817516
N -3.447128 0.621250 0.131717
N -2.753212 2.720923 -0.846907
N -5.479002 0.608070 1.489355
N -4.995534 1.845158 -1.179769
N -4.573568 -1.429691 0.499963
C 0.331985 -1.242513 -0.280878
C 2.987006 -0.657752 -0.043158
C -2.187224 -0.063824 -0.052142
C -0.338686 -1.255482 0.948101
C -0.284060 -0.686192 -1.404804
C -1.590574 -0.658839 1.077169
C -1.539141 -0.085332 -1.301428
C 3.355903 -0.419544 1.282190
C 3.507547 0.128835 -1.072816
C 4.223056 0.634400 1.592321
C 4.375963 1.186376 -0.779982
C 4.716205 1.426549 0.553213
C -3.782467 1.739305 -0.729027
C -4.568560 -0.154829 0.682379
H 0.118035 -1.744532 1.817151
H 0.211313 -0.734482 -2.382419
H -2.116693 -0.674251 2.032424
H -2.029708 0.300203 -2.192412
H 2.981561 -1.064798 2.085318
H 3.250983 -0.087974 -2.116731
H 4.510392 0.821993 2.627891
H 4.782987 1.801153 -1.583806
H -2.688671 3.199242 -1.736648
H -1.839806 2.508241 -0.462611
H -6.441584 0.565540 1.153000
H -5.225708 1.584927 1.626513
H -5.279640 2.676430 -1.688425
H -5.276301 -2.011478 0.946585


%chk=000215635-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000215635

0 1
Br 6.312439 2.904747 0.092188
S 1.887531 -2.017337 0.004338
O 2.042710 -2.780949 1.443980
O 2.069595 -2.753251 -1.446689
N -3.660759 0.570674 -0.025944
N -2.538568 2.653479 -0.048798
N -6.021887 0.237208 -0.021882
N -4.944109 2.573249 -0.065837
N -4.436904 -1.629508 0.012980
C 0.178119 -1.194900 -0.004408
C 3.129536 -0.579976 0.029562
C -2.348564 -0.057154 -0.018296
C -0.439744 -0.945415 1.231175
C -0.420961 -0.934701 -1.246726
C -1.724244 -0.359996 1.214634
C -1.706095 -0.349796 -1.244298
C 3.578536 -0.114195 1.274807
C 3.602153 -0.091339 -1.198042
C 4.531075 0.930643 1.293131
C 4.554688 0.953477 -1.178847
C 4.996226 1.453602 0.066192
C -3.759967 1.980967 -0.048177
C -4.778919 -0.357085 -0.010127
H 0.053402 -1.232716 2.165530
H 0.086600 -1.213908 -2.175827
H -2.260425 -0.163657 2.147733
H -2.228198 -0.145495 -2.183759
H 3.219724 -0.574041 2.201552
H 3.261117 -0.533890 -2.139786
H 4.907408 1.320231 2.242837
H 4.949015 1.360413 -2.113849
H -2.535304 3.669124 -0.066342
H -1.649865 2.158682 -0.031810
H -6.849199 -0.353321 -0.012394
H -6.034410 1.292845 -0.043288
H -4.916135 3.603058 -0.077299
H -5.248416 -2.271973 0.023088


