%chk=000240570.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000240570

0 1
Br 1.357347 -3.243618 -1.728484
Cl -3.212150 -0.998561 -2.386467
S 3.296877 1.696724 1.716734
N 0.086604 -0.498941 -1.566742
N 1.571323 0.502065 0.028208
N 3.485645 -0.773290 0.845334
C -0.810376 0.682506 -1.531817
C -1.920639 0.490814 -0.528734
C 1.172211 -0.593579 -0.722387
C -3.068577 -0.252981 -0.833016
C -1.814937 1.048325 0.754259
C -4.106389 -0.427117 0.084245
C -2.842751 0.881517 1.686502
C 1.935744 -1.799596 -0.681741
C -3.987978 0.150330 1.352006
C 2.708418 0.350661 0.756798
C 3.082508 -1.847313 0.114197
C 2.132024 3.026656 1.377331
H -1.213425 0.835078 -2.562472
H -0.220517 1.604095 -1.297218
H -0.340072 -1.349509 -1.945804
H -0.913066 1.603369 1.023844
H -4.990364 -1.006149 -0.183308
H -2.749081 1.319444 2.680010
H -4.788538 0.024700 2.080859
H 3.705521 -2.750179 0.182951
H 2.037100 3.227016 0.301211
H 2.508017 3.932709 1.870609
H 1.130120 2.802325 1.762892


%chk=000240570-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000240570

0 1
Br 1.486410 -3.378506 -1.837247
Cl -3.091091 -1.256176 -2.317572
S 3.453218 1.689017 1.684535
N 0.082902 -0.508829 -1.469790
N 1.672813 0.435590 0.002671
N 3.656165 -0.793670 0.711425
C -0.786073 0.680016 -1.424190
C -1.960682 0.528184 -0.460944
C 1.245687 -0.630568 -0.754445
C -3.066955 -0.306595 -0.741529
C -1.983081 1.226944 0.773102
C -4.158723 -0.458696 0.131572
C -3.062935 1.095961 1.673826
C 2.043459 -1.823562 -0.781701
C -4.151929 0.254389 1.352932
C 2.840875 0.301767 0.680663
C 3.229779 -1.857749 -0.036921
C 2.097063 2.957865 1.405193
H -1.160643 0.862341 -2.447681
H -0.162130 1.533567 -1.118132
H -0.246818 -1.323232 -1.993505
H -1.132703 1.871740 1.020788
H -4.992017 -1.115658 -0.132972
H -3.054784 1.645169 2.620967
H -4.993858 0.146137 2.044574
H 3.865167 -2.748730 -0.027827
H 2.012271 3.188326 0.333833
H 2.409078 3.849363 1.971557
H 1.140134 2.573094 1.786619


