%chk=000269127.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000269127

0 1
Cl 4.181086 -3.094174 2.657443
Cl 2.903300 -2.458336 -2.520140
S 1.188339 2.309140 -0.088931
O 1.244207 3.558053 0.640016
O 1.709218 2.191706 -1.427631
O -4.315145 -1.438684 -1.469208
N 2.116996 1.258871 0.948997
N -4.308061 0.107232 0.246027
C -0.389000 1.654569 -0.010715
C -0.799216 0.662253 -0.913486
C -1.291699 2.125981 0.954007
C 2.597839 -0.024182 0.634663
C -2.983537 0.602124 0.123192
C -2.083129 0.132044 -0.853516
C -2.579833 1.611656 1.032718
C 2.547548 -0.531652 -0.682770
C 3.121696 -0.827257 1.679279
C 3.549288 -2.115617 1.380142
C 2.983545 -1.832588 -0.912330
C 3.485943 -2.659242 0.095497
C -4.913041 -0.900255 -0.566448
C -6.330426 -1.201561 -0.180506
H 2.399169 1.624925 1.870555
H -0.106220 0.298914 -1.683605
H -0.982798 2.916316 1.650458
H -2.390531 -0.645819 -1.564393
H -3.266106 1.989724 1.786497
H 2.234036 0.096764 -1.524988
H 3.186494 -0.447172 2.696110
H -4.872612 0.523396 0.992542
H 3.819899 -3.673928 -0.112195
H -6.993495 -0.330660 -0.279449
H -6.739636 -1.985334 -0.844051
H -6.420618 -1.582907 0.846321


%chk=000269127-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000269127

0 1
Cl 4.149808 -3.110173 2.895298
Cl 2.994458 -2.613027 -2.514592
S 1.252614 2.390282 -0.149544
O 1.273865 3.763192 0.719681
O 1.749605 2.314981 -1.692106
O -4.537747 -1.316249 -1.686908
N 2.298277 1.319473 0.892706
N -4.332796 0.020843 0.233456
C -0.460678 1.626736 -0.056756
C -0.887496 0.772870 -1.086032
C -1.267251 1.977715 1.039864
C 2.695265 -0.004363 0.634542
C -3.021860 0.538572 0.091689
C -2.180944 0.217897 -1.011870
C -2.557040 1.424689 1.107400
C 2.657369 -0.561832 -0.674211
C 3.147340 -0.793543 1.732063
C 3.558731 -2.113074 1.488499
C 3.051332 -1.899455 -0.839814
C 3.514782 -2.711248 0.213978
C -5.028892 -0.854297 -0.620208
C -6.435740 -1.191938 -0.133302
H 2.617170 1.833531 1.719252
H -0.238656 0.560348 -1.941138
H -0.906452 2.678760 1.798798
H -2.550150 -0.450983 -1.790454
H -3.210231 1.685738 1.948965
H 2.379560 0.053587 -1.533566
H 3.166017 -0.383377 2.745695
H -4.840196 0.327140 1.067621
H 3.827710 -3.744122 0.051556
H -7.061724 -0.283949 -0.052381
H -6.900944 -1.877515 -0.855319
H -6.411605 -1.682909 0.857237


