%chk=000298340.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000298340

0 1
Cl 5.162129 -2.176020 -0.235585
S -3.283530 -2.112717 0.529130
O -2.986615 -2.740088 -0.743852
O -3.446933 -2.935362 1.711606
O -0.203632 1.853038 1.976883
O -1.810805 2.586552 0.603127
O 2.135632 1.378267 -1.138122
N 0.886325 0.110507 0.340958
N 3.276951 0.225459 0.521485
C -1.454942 -0.315664 -0.381310
C -1.988949 -0.950595 0.893725
C -0.354762 0.741603 -0.148417
C -0.892233 1.827060 0.787711
C -4.716749 -1.124837 0.338491
C 2.112441 0.631307 -0.170803
C 4.575236 0.465684 -0.154264
C 4.949408 -0.642072 -1.135462
H -2.273540 0.166957 -0.959042
H -1.042354 -1.109286 -1.054219
H -1.167188 -1.474543 1.430468
H -2.321894 -0.188130 1.623002
H -0.129159 1.254869 -1.141396
H 0.848510 -0.199944 1.314421
H -5.350010 -1.470319 -0.495571
H -5.371674 -1.152636 1.223058
H -4.529334 -0.064697 0.132670
H 3.249294 -0.630176 1.082130
H 4.528802 1.445061 -0.697939
H 5.349148 0.570330 0.643024
H -0.507981 2.581387 2.584811
H 5.899185 -0.421052 -1.658587
H 4.165523 -0.805544 -1.902132


%chk=000298340-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000298340

0 1
Cl 5.052530 -2.187268 0.719377
S -2.464130 -2.223013 0.133633
O -1.628570 -2.506086 -1.245114
O -2.567757 -3.347098 1.317026
O -0.211882 2.336461 2.710660
O -2.178946 2.809200 1.567742
O 1.501165 0.993461 -1.498279
N 0.894902 0.977924 0.755932
N 3.035539 0.239573 0.107862
C -1.416265 0.443879 -0.111305
C -1.726138 -0.611375 0.944210
C -0.417445 1.527363 0.418866
C -1.044018 2.291017 1.581226
C -4.252537 -1.750932 -0.371500
C 1.802794 0.749510 -0.285890
C 4.064454 -0.090964 -0.879902
C 4.357477 -1.589626 -0.950298
H -2.333804 0.961752 -0.442712
H -0.936682 -0.026472 -0.989957
H -0.821701 -1.012498 1.432905
H -2.482839 -0.327662 1.693777
H -0.291765 2.245315 -0.418531
H 1.193735 1.015761 1.731946
H -4.660675 -2.667762 -0.819024
H -4.787920 -1.468308 0.545509
H -4.184909 -0.934767 -1.103650
H 3.199329 -0.059601 1.071408
H 3.678334 0.242627 -1.861848
H 4.998355 0.463422 -0.669092
H -0.657427 2.847187 3.439191
H 5.140302 -1.825501 -1.686064
H 3.452792 -2.191122 -1.118107


