%chk=000256569.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000256569

0 1
Cl -7.115024 1.317328 2.104515
S 0.970464 3.958896 0.593773
N 0.085314 1.505326 0.411050
N -2.363171 -0.144430 0.758884
C 0.025322 0.084357 -0.027113
C -1.038970 1.944827 1.291321
C -1.416057 -0.314328 -0.389644
C -1.813515 0.732224 1.830174
C 1.060950 2.375598 0.065596
C -3.742799 -0.032753 0.423604
C 2.213710 1.963775 -0.804434
C 3.045376 0.847278 -0.229865
C -4.654864 0.587715 1.308709
C -4.243730 -0.658732 -0.744586
C 3.380782 -0.300545 -1.031429
C 4.164987 -1.333329 -0.452503
C 3.505067 0.940628 1.065674
C -6.011871 0.556126 1.007461
C -5.612607 -0.664252 -1.008307
C 2.961841 -0.443334 -2.393425
C 4.614554 -1.209414 0.900136
C 4.294809 -0.096480 1.635208
C -6.522028 -0.054381 -0.137461
C 4.499061 -2.485985 -1.234994
C 3.297258 -1.555104 -3.123317
C 4.075070 -2.594654 -2.534706
H 0.681162 -0.088260 -0.911018
H 0.425784 -0.565308 0.788370
H -1.706567 2.628358 0.712801
H -0.640096 2.549821 2.145668
H -1.432089 -1.394773 -0.669897
H -1.749122 0.268821 -1.279925
H -2.624390 1.087241 2.511281
H -1.152628 0.089966 2.460721
H 1.847083 1.728014 -1.831525
H 2.888082 2.848441 -0.964950
H -4.306782 1.077636 2.218921
H -3.576600 -1.161177 -1.438584
H 3.275125 1.817452 1.675955
H -5.983045 -1.153811 -1.910675
H 2.379276 0.361504 -2.846908
H 5.217229 -2.009431 1.327498
H 4.639563 0.015587 2.663194
H -7.588797 -0.058036 -0.345366
H 5.099742 -3.270401 -0.775464
H 2.982391 -1.660020 -4.160661
H 4.326950 -3.466879 -3.136458


%chk=000256569-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000256569

0 1
Cl -6.561097 -0.654833 3.219778
S 1.673440 4.197796 0.716761
N 0.194159 1.991589 0.124381
N -2.453687 0.733775 0.283955
C -0.101797 0.675290 -0.498348
C -0.909125 2.574840 0.931138
C -1.586315 0.574863 -0.896671
C -1.891704 1.495211 1.415114
C 1.391562 2.654023 0.005355
C -3.722314 0.143966 0.342815
C 2.503052 1.967454 -0.791325
C 3.027638 0.674324 -0.152291
C -4.426168 0.044889 1.584919
C -4.352365 -0.378138 -0.831529
C 3.393303 -0.477764 -0.948122
C 3.893050 -1.666377 -0.274829
C 3.189616 0.625381 1.239638
C -5.698735 -0.545277 1.607895
C -5.627046 -0.971743 -0.757450
C 3.293423 -0.513782 -2.382248
C 4.031953 -1.669496 1.151493
C 3.692196 -0.539105 1.894439
C -6.333013 -1.066602 0.465325
C 4.247029 -2.821166 -1.049367
C 3.647396 -1.653267 -3.109504
C 4.125621 -2.822294 -2.439246
H 0.515192 0.537125 -1.399658
H 0.155305 -0.141896 0.204104
H -1.437873 3.341598 0.331278
H -0.459880 3.103440 1.791106
H -1.743815 -0.426985 -1.339316
H -1.814996 1.327059 -1.683071
H -2.708305 2.015844 1.947767
H -1.389900 0.829011 2.150729
H 2.150780 1.787682 -1.824471
H 3.322806 2.701670 -0.868665
H -3.980454 0.389445 2.520515
H -3.863508 -0.294183 -1.806176
H 2.928925 1.508498 1.834867
H -6.090963 -1.357610 -1.671963
H 2.954371 0.373091 -2.928001
H 4.413587 -2.570773 1.645613
H 3.808360 -0.536488 2.983638
H -7.325202 -1.519645 0.523829
H 4.621120 -3.708598 -0.524745
H 3.566226 -1.651346 -4.202124
H 4.400355 -3.709394 -3.020034


