%chk=000207876.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000207876

0 1
Cl -2.006707 2.261198 0.231776
S -3.499640 -0.472982 1.306425
S 2.319899 0.024832 -2.736158
P 3.073511 0.326566 -1.038419
O -3.657811 -1.704797 2.056993
O -3.935412 0.774728 1.896867
O 2.303487 -0.469183 0.239687
O 3.073312 1.888243 -0.588324
O 4.569803 -0.216609 -0.677892
N -4.325247 -0.680441 -0.174070
C -5.503036 0.180022 -0.454987
C -3.670196 -1.313918 -1.340677
C -1.800378 -0.366530 0.915358
C -1.149811 0.784946 0.479496
C -1.035441 -1.532101 1.117769
C -5.161881 1.644881 -0.726752
C -2.868345 -0.360650 -2.229270
C 0.944461 -0.372898 0.399078
C 0.223634 0.813332 0.212403
C 0.328438 -1.553571 0.859852
C 3.666416 2.260465 0.697803
C 4.914671 -1.564797 -1.158555
C 5.174789 2.322349 0.595226
C 6.369167 -1.696566 -0.755585
H -6.189265 0.111997 0.423437
H -6.056043 -0.249488 -1.320971
H -4.467392 -1.802750 -1.951701
H -3.018685 -2.141344 -0.978110
H -1.529419 -2.442471 1.493580
H -6.040687 2.199810 -1.068709
H -4.377312 1.748246 -1.488681
H -4.801473 2.140252 0.191074
H -2.726948 -0.780089 -3.231615
H -1.870533 -0.149286 -1.829760
H -3.379709 0.607681 -2.348433
H 0.697624 1.740028 -0.122353
H 0.927823 -2.449941 1.009637
H 3.211644 3.265536 0.831628
H 3.310245 1.580828 1.494129
H 4.266328 -2.297280 -0.640958
H 4.778511 -1.616235 -2.256725
H 5.636645 1.322680 0.535936
H 5.493297 2.870659 -0.303421
H 5.611916 2.831422 1.463232
H 6.985515 -0.915017 -1.222457
H 6.495134 -1.591038 0.331183
H 6.778702 -2.670519 -1.050885


%chk=000207876-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000207876

0 1
Cl -1.833139 2.372255 0.275474
S -3.451446 -0.519403 1.235896
S 2.725593 0.688659 -2.795768
P 3.456530 0.575156 -0.891719
O -3.667699 -2.084046 1.674798
O -3.941273 0.663563 2.241537
O 2.558152 -0.463835 0.249574
O 3.574270 2.074334 -0.079627
O 4.996675 -0.123993 -0.576143
N -4.186666 -0.148548 -0.540217
C -5.405610 0.708511 -0.395364
C -4.405290 -1.473933 -1.202124
C -1.596115 -0.381325 0.873214
C -0.951348 0.805727 0.482071
C -0.867471 -1.573807 1.050204
C -5.361835 1.882503 -1.395660
C -4.658555 -1.269378 -2.709157
C 1.162638 -0.394751 0.417602
C 0.437790 0.810061 0.249796
C 0.519404 -1.588205 0.817031
C 4.188931 2.170261 1.295697
C 5.321586 -1.452521 -1.190290
C 5.658049 2.573478 1.194931
C 6.816848 -1.664103 -0.982072
H -5.412615 1.120352 0.634160
H -6.328672 0.103455 -0.520286
H -5.246607 -2.034499 -0.741381
H -3.491055 -2.079188 -1.064015
H -1.407314 -2.472453 1.368879
H -6.244353 2.531756 -1.242781
H -5.362971 1.533712 -2.441855
H -4.450282 2.481234 -1.234721
H -4.709858 -2.256283 -3.204056
H -3.840498 -0.687099 -3.166646
H -5.611744 -0.746111 -2.896641
H 0.939652 1.736199 -0.046484
H 1.108169 -2.500550 0.940525
H 3.575168 2.947941 1.779911
H 4.051898 1.210123 1.826273
H 4.716011 -2.222900 -0.679103
H 5.051266 -1.420876 -2.263129
H 6.251318 1.774997 0.720494
H 5.766345 3.500363 0.606797
H 6.058729 2.758839 2.209742
H 7.398641 -0.875447 -1.487810
H 7.068874 -1.657270 0.091884
H 7.113479 -2.642754 -1.402339


