%chk=000294470.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000294470

0 1
Cl 5.795309 1.248405 -1.426506
Cl -5.795763 1.201049 1.460555
S 0.000449 -0.416622 -0.007644
S 0.781366 2.368935 0.705138
S -0.782098 2.388708 -0.636102
O 5.615763 -0.810692 1.426314
O -5.614742 -0.771472 -1.452752
N 3.784361 -0.997264 0.081635
N -3.783065 -0.996566 -0.114403
C 1.430063 0.705780 0.311158
C -1.429822 0.714050 -0.292458
C 2.150580 0.205656 1.552306
C 2.310636 0.753311 -0.924177
C -2.310410 0.723795 0.943739
C -2.150065 0.251160 -1.548123
C 2.902723 -1.110939 1.279709
C 3.048674 -0.581756 -1.140574
C -3.047648 -0.617634 1.119794
C -2.901398 -1.073518 -1.315367
C 5.140887 -0.708565 0.307626
C -5.139855 -0.702453 -0.331537
C 6.034218 -0.426172 -0.890424
C -6.033344 -0.456898 0.874493
H 1.450834 0.059388 2.402902
H 2.883458 0.967479 1.906059
H 3.058452 1.573990 -0.827890
H 1.727536 1.003631 -1.836057
H -3.058725 1.546551 0.872215
H -1.727454 0.946869 1.862753
H -1.450248 0.131039 -2.402745
H -2.883410 1.022867 -1.878727
H 3.521849 -1.385542 2.168705
H 2.193313 -1.950487 1.105241
H 2.321507 -1.392734 -1.387703
H 3.731874 -0.503698 -2.011509
H -2.319993 -1.435247 1.342391
H -3.730902 -0.566243 1.992669
H -3.520386 -1.321548 -2.212239
H -2.191466 -1.917509 -1.166322
H 5.851621 -1.113255 -1.738338
H 7.098800 -0.544963 -0.584358
H -5.850136 -1.168950 1.701408
H -7.097844 -0.567335 0.565048


%chk=000294470-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000294470

0 1
Cl 6.199663 1.042279 -1.415942
Cl -6.192425 0.995119 1.453005
S 0.000843 -0.377889 -0.009775
S 0.708123 2.512232 0.914810
S -0.711122 2.537045 -0.846462
O 5.719339 -1.459828 1.328016
O -5.721520 -1.421397 -1.369857
N 3.827053 -0.844483 0.110914
N -3.826247 -0.844064 -0.138757
C 1.454058 0.833505 0.413335
C -1.454379 0.843566 -0.393934
C 2.212367 0.279223 1.641928
C 2.391379 0.971964 -0.802088
C -2.390065 0.944490 0.826445
C -2.214630 0.326442 -1.637552
C 2.954226 -1.034782 1.289812
C 3.123929 -0.359510 -1.097695
C -3.120262 -0.396381 1.082605
C -2.956055 -0.997679 -1.324948
C 5.191772 -1.047149 0.245601
C -5.191309 -1.042138 -0.276555
C 6.090887 -0.801428 -0.966369
C -6.087613 -0.833457 0.944412
H 1.511021 0.099329 2.475194
H 2.958146 1.030573 1.967876
H 3.146187 1.750144 -0.578679
H 1.816520 1.291803 -1.688773
H -3.146436 1.727732 0.627228
H -1.814722 1.238584 1.721658
H -1.514642 0.172303 -2.477114
H -2.960904 1.087531 -1.938861
H 3.590443 -1.360627 2.127996
H 2.216975 -1.834006 1.074079
H 2.386076 -1.124922 -1.412274
H 3.834642 -0.201624 -1.921442
H -2.380944 -1.170756 1.370809
H -3.828767 -0.265430 1.913001
H -3.594204 -1.297019 -2.171510
H -2.218538 -1.803365 -1.135792
H 5.760672 -1.311613 -1.884069
H 7.112384 -1.092425 -0.693900
H -5.756265 -1.373314 1.844554
H -7.110155 -1.113977 0.664972


