%chk=000238758.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000238758

0 1
Cl 0.000448 2.062276 0.000009
S 2.763073 0.411425 -0.027735
S -2.762172 0.411400 0.026203
N 1.207669 -1.739536 -0.013248
N -1.206767 -1.739548 0.009768
C 5.287926 -0.270164 -0.052662
C -5.287031 -0.270232 0.050561
C 3.965370 -0.960217 -0.039599
C -3.964464 -0.960256 0.036905
C 5.926336 0.055260 1.155242
C 5.901840 0.056223 -1.272920
C -5.925413 0.056281 -1.157067
C -5.900983 0.055036 1.271102
C 1.201661 -0.377936 -0.012742
C -1.200759 -0.377947 0.010500
C 0.000451 0.361962 -0.000782
C 7.167329 0.696762 1.139264
C 7.142923 0.697740 -1.281468
C -7.166424 0.697737 -1.140538
C -7.142084 0.696514 1.280198
C 7.777865 1.018343 -0.077263
C -7.777003 1.018194 0.076267
C 0.000451 -2.374511 -0.002033
H 3.803407 -1.613525 -0.921100
H 3.820798 -1.613527 0.844883
H -3.802487 -1.614319 0.917846
H -3.819891 -1.612817 -0.848132
H 5.454021 -0.188454 2.105920
H 5.410467 -0.186731 -2.214090
H -5.453061 -0.186552 -2.107953
H -5.409624 -0.188755 2.212064
H 7.659174 0.947900 2.077931
H 7.615700 0.949633 -2.229681
H -7.658251 0.949719 -2.078988
H -7.614894 0.947534 2.228626
H 8.744598 1.518181 -0.086794
H -8.743750 1.517995 0.086225
H 0.000452 -3.476089 -0.002515


%chk=000238758-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000238758

0 1
Cl 0.000438 2.370037 -0.000411
S 2.805128 0.721415 -0.029555
S -2.804243 0.721381 0.027618
N 1.215123 -1.531860 -0.014029
N -1.214227 -1.531874 0.010432
C 5.426469 -0.258478 -0.054549
C -5.425575 -0.258553 0.052415
C 4.011258 -0.780067 -0.041041
C -4.010362 -0.780116 0.038115
C 6.114719 -0.007219 1.160968
C 6.092933 -0.011499 -1.283007
C -6.114169 -0.006373 -1.162715
C -6.091699 -0.012528 1.281249
C 1.220401 -0.160872 -0.013623
C -1.219512 -0.160887 0.011020
C 0.000443 0.558615 -0.001049
C 7.441814 0.475508 1.149479
C 7.420027 0.471204 -1.297003
C -7.441272 0.476316 -1.150479
C -7.418799 0.470139 1.295993
C 8.098355 0.716000 -0.080137
C -8.097474 0.715851 0.079504
C 0.000449 -2.141338 -0.002024
H 3.755462 -1.370308 -0.933162
H 3.772576 -1.370106 0.855960
H -3.754339 -1.371110 0.929672
H -3.771902 -1.369395 -0.859445
H 5.606752 -0.190394 2.115457
H 5.568048 -0.198158 -2.227627
H -5.606471 -0.188804 -2.117489
H -5.566543 -0.199903 2.225577
H 7.962709 0.662631 2.095007
H 7.923930 0.654892 -2.252358
H -7.962439 0.664156 -2.095715
H -7.922435 0.653081 2.251632
H 9.128367 1.089493 -0.089933
H -9.127491 1.089315 0.089874
H 0.000452 -3.235195 -0.002417


