%chk=000291503.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000291503

0 1
Cl 1.046942 -0.326611 3.593143
S 3.419699 -1.342045 -0.259300
O -3.581970 -0.204434 -1.474347
O 4.625562 -1.872536 0.338878
O 2.794640 -1.997919 -1.384214
N -3.189608 0.024683 0.774726
N 2.310617 -1.336898 1.063557
C -5.491444 0.478840 -0.109535
C -5.546981 1.786748 0.690049
C -6.169373 -0.666958 0.652502
C -6.158712 0.675361 -1.476654
C -4.012333 0.071899 -0.372121
C -1.806638 -0.337946 0.803098
C 0.932883 -1.027264 0.966719
C -1.118338 -0.190269 2.022556
C -1.127056 -0.842397 -0.324657
C 0.230962 -0.529295 2.085508
C 0.214758 -1.189847 -0.238443
C 3.624468 0.331500 -0.620865
C 4.647349 1.055030 0.002424
C 2.777797 0.961594 -1.539059
C 4.818439 2.411798 -0.285563
C 2.947125 2.318989 -1.827291
C 3.966144 3.043011 -1.198804
H -5.216374 1.668071 1.726223
H -6.574450 2.172121 0.730660
H -4.932753 2.569716 0.228105
H -5.736705 -0.832744 1.643770
H -6.098628 -1.613701 0.100416
H -7.237510 -0.461989 0.796984
H -5.698763 1.499784 -2.035945
H -7.227043 0.889021 -1.378243
H -6.049988 -0.219137 -2.106879
H -3.592989 0.285208 1.676108
H -1.620078 0.187437 2.912571
H -1.662264 -0.970352 -1.275789
H 2.644710 -1.621615 1.995551
H 0.706795 -1.628240 -1.118861
H 5.321294 0.558408 0.709893
H 1.985426 0.394625 -2.040709
H 5.614464 2.975481 0.199092
H 2.286540 2.810054 -2.541003
H 4.098183 4.102617 -1.422855


%chk=000291503-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000291503

0 1
Cl 1.548056 0.512568 3.048255
S 3.531593 -1.448050 -0.376987
O -3.923313 -1.138138 -1.130921
O 4.981205 -1.910176 0.192571
O 2.838385 -2.101354 -1.692189
N -3.032293 0.131373 0.622526
N 2.281534 -1.855381 1.123242
C -5.428404 0.478693 -0.054399
C -5.428600 1.582627 1.033536
C -6.469667 -0.618544 0.315778
C -5.804588 1.100851 -1.430049
C -4.065601 -0.247088 -0.242307
C -1.708243 -0.373174 0.693645
C 0.987220 -1.314166 0.984336
C -0.851525 0.196020 1.678238
C -1.213448 -1.409611 -0.149658
C 0.466576 -0.257287 1.788054
C 0.101833 -1.871053 0.013148
C 3.567260 0.430800 -0.644553
C 4.514449 1.178454 0.075031
C 2.651939 0.983596 -1.555578
C 4.537584 2.576275 -0.135580
C 2.689367 2.384818 -1.746659
C 3.624988 3.174660 -1.037467
H -5.219416 1.179816 2.044572
H -6.431551 2.043036 1.081231
H -4.714997 2.398960 0.806011
H -6.244937 -1.074449 1.297866
H -6.467906 -1.416836 -0.445122
H -7.481119 -0.174972 0.364091
H -5.101989 1.905853 -1.715247
H -6.822105 1.530200 -1.382431
H -5.780773 0.327795 -2.216007
H -3.260332 0.865161 1.296458
H -1.210087 0.990227 2.342275
H -1.874050 -1.846767 -0.899221
H 2.798441 -1.493933 1.948788
H 0.484008 -2.687901 -0.605797
H 5.222418 0.683565 0.747827
H 1.960065 0.340114 -2.108346
H 5.267980 3.192264 0.399060
H 1.994687 2.852529 -2.451945
H 3.650154 4.258422 -1.194678


