%chk=000272026.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000272026

0 1
Cl -9.709798 -2.095556 0.209126
S -5.603812 -0.776149 0.135322
C 1.337299 -0.294767 0.038951
C 0.646072 0.920158 0.006505
C 2.774951 -0.302369 0.021531
C 1.348308 2.156107 -0.043860
C 2.772251 2.141416 -0.060986
C 3.482921 -1.586840 0.056252
C 3.459335 0.906484 -0.027754
C -0.837265 0.936256 0.024283
C 2.744472 -2.791878 0.105927
C 0.630028 -1.567091 0.090410
C 1.291748 -2.744393 0.122002
C 0.671937 3.426511 -0.078256
C 3.486785 3.390171 -0.112002
C 4.896662 -1.657120 0.041411
C -1.555588 0.905565 -1.180630
C -1.525675 0.981878 1.246066
C 3.422281 -4.033501 0.139595
C 1.379121 4.595060 -0.126447
C -3.642739 0.969334 0.057827
C 2.811146 4.577508 -0.143672
C -2.950905 0.921105 -1.163535
C -2.921003 0.997411 1.262394
C 5.548325 -2.879970 0.074763
C 4.807155 -4.077069 0.124206
C -5.135656 0.986448 0.075662
C -7.426339 -0.684645 0.158908
C -7.909362 -2.116356 0.183732
H 4.551117 0.915766 -0.041541
H -0.462023 -1.535735 0.102598
H 0.757294 -3.693585 0.160449
H -0.418906 3.432848 -0.064858
H 4.575182 3.361286 -0.124549
H 5.477432 -0.734181 0.003181
H -1.020021 0.867002 -2.129227
H -0.966883 1.002599 2.181737
H 2.844367 -4.955763 0.177770
H 0.872109 5.558183 -0.152593
H 3.341662 5.527561 -0.182327
H -3.502213 0.888261 -2.102689
H -3.448987 1.024064 2.215046
H 6.636106 -2.922835 0.062968
H 5.329439 -5.031958 0.150088
H -5.540481 1.525922 0.952909
H -5.562248 1.471648 -0.822722
H -7.800657 -0.143869 -0.732007
H -7.775729 -0.121185 1.045937
H -7.604087 -2.690571 -0.713971
H -7.578527 -2.668069 1.086470


%chk=000272026-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000272026

0 1
Cl -10.286550 -1.582973 0.149922
S -5.814542 -0.952339 -0.135037
C 1.440945 -0.317172 0.063599
C 0.693706 0.896036 -0.003575
C 2.899011 -0.291221 0.011576
C 1.368639 2.154860 -0.135808
C 2.821182 2.172798 -0.204675
C 3.650369 -1.556834 0.094347
C 3.542897 0.953040 -0.125887
C -0.805905 0.865701 0.068724
C 2.929916 -2.798708 0.199864
C 0.772048 -1.603786 0.155487
C 1.481193 -2.783403 0.218000
C 0.670698 3.414775 -0.180799
C 3.504079 3.431768 -0.339374
C 5.076221 -1.613115 0.075890
C -1.597820 1.160896 -1.072495
C -1.470265 0.552268 1.283966
C 3.642807 -4.032369 0.278841
C 1.363382 4.617512 -0.306749
C -3.668248 0.832208 0.215226
C 2.795761 4.629208 -0.393407
C -3.006503 1.139058 -1.001463
C -2.879003 0.537078 1.356385
C 5.763013 -2.835056 0.155686
C 5.043863 -4.057831 0.257514
C -5.174584 0.807819 0.290039
C -7.679097 -0.584837 0.019752
C -8.422289 -1.913503 0.021516
H 4.635152 1.008984 -0.176864
H -0.321359 -1.623321 0.161894
H 0.953283 -3.742515 0.280401
H -0.420923 3.418670 -0.106373
H 4.599304 3.431221 -0.394609
H 5.661159 -0.691440 0.001032
H -1.102052 1.398769 -2.020178
H -0.874329 0.329996 2.176174
H 3.073380 -4.966181 0.357559
H 0.813946 5.564991 -0.336322
H 3.325312 5.582764 -0.494824
H -3.599430 1.357793 -1.897582
H -3.371916 0.293527 2.305129
H 6.858397 -2.845620 0.140268
H 5.583041 -5.009254 0.319442
H -5.540744 1.044354 1.303285
H -5.632499 1.497137 -0.439044
H -7.989848 0.045478 -0.829467
H -7.844677 -0.041979 0.965689
H -8.291703 -2.477099 -0.914061
H -8.171819 -2.537054 0.891789


