%chk=000276178.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000276178

0 1
Cl 2.123925 -3.450268 2.216175
S -7.125525 2.028870 -0.974727
F -8.387018 1.066329 -1.040375
O -1.636290 -1.900104 -1.398996
O -7.505938 2.969620 0.042367
O -6.940872 2.429301 -2.340091
N 4.663092 0.412212 -0.011702
N 5.447645 2.631779 0.855103
N 6.325258 1.695163 -1.225726
N 5.539884 -0.309518 -2.161129
N -0.818720 -3.010686 0.458358
N 6.736903 3.956560 -0.617238
N -2.714003 -1.577650 0.646614
C 4.742056 1.393791 1.198023
C 3.587802 -0.537785 -0.084236
C 3.317510 1.762391 1.623106
C 5.517807 0.664850 2.306543
C 5.525335 0.631200 -1.113660
C 3.405489 -1.449048 0.972628
C 2.716532 -0.562609 -1.192480
C 6.144849 2.738614 -0.262455
C 1.498375 -2.428588 -0.210776
C 2.359744 -2.364579 0.890560
C 1.687160 -1.498806 -1.247682
C 0.387229 -3.441608 -0.298035
C -3.769066 -0.730033 0.220631
C -5.768070 0.512162 0.852150
C -5.884789 0.980210 -0.471517
C -1.698610 -2.120747 -0.204076
C -4.710886 -0.341944 1.195185
C -3.888351 -0.266232 -1.107709
C -4.937655 0.575423 -1.433797
C -6.753411 0.892372 1.900125
H 3.353727 2.581902 2.359124
H 2.725034 2.141169 0.780033
H 2.777004 0.929668 2.079594
H 5.642347 1.331239 3.172424
H 5.004749 -0.242116 2.648106
H 6.525250 0.380740 1.980471
H 4.072211 -1.429673 1.841712
H 2.844235 0.157400 -2.005037
H 1.000158 -1.503133 -2.101543
H 0.098921 -3.620461 -1.365710
H 0.701304 -4.433540 0.107169
H 6.273176 -0.177887 -2.855373
H 5.361658 -1.278567 -1.933945
H -0.670351 -2.927460 1.464695
H 6.883030 4.627533 0.125087
H 7.458703 3.928237 -1.324608
H -4.629409 -0.699630 2.218411
H -2.748829 -1.881464 1.624125
H -3.163226 -0.572249 -1.871574
H -5.031346 0.938444 -2.468677
H -6.998063 1.977057 1.887074
H -7.713593 0.366672 1.768733
H -6.412080 0.671277 2.920050


%chk=000276178-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000276178

0 1
Cl 1.749600 -3.258242 2.269676
S -7.471191 2.125036 -0.711840
F -8.895673 0.915504 -0.533943
O -1.696023 -1.685405 -1.658239
O -7.727398 3.213157 0.445614
O -7.424314 2.564636 -2.257756
N 4.792625 0.419338 0.055453
N 5.413150 2.763221 0.580394
N 6.772283 1.385392 -0.926358
N 6.145195 -0.783111 -1.498785
N -0.867555 -2.847833 0.187283
N 7.091212 3.691663 -0.772774
N -2.846890 -1.612704 0.411290
C 4.806614 1.539979 1.132581
C 3.716963 -0.513649 -0.087183
C 3.363594 1.886390 1.544792
C 5.647813 1.053500 2.345300
C 5.913582 0.373816 -0.781962
C 3.326537 -1.348183 0.996093
C 3.005650 -0.608077 -1.315126
C 6.374123 2.600444 -0.319057
C 1.519034 -2.346621 -0.382152
C 2.242043 -2.221892 0.825396
C 1.936341 -1.514077 -1.453603
C 0.335725 -3.295025 -0.539681
C -3.919423 -0.752116 0.099485
C -5.972048 0.360856 0.953779
C -6.080352 0.945746 -0.333580
C -1.791895 -2.020166 -0.440457
C -4.862701 -0.490559 1.135882
C -4.088524 -0.150389 -1.179510
C -5.184271 0.702363 -1.390493
C -6.967392 0.595571 2.071171
H 3.418034 2.765745 2.206582
H 2.767529 2.164675 0.659396
H 2.859615 1.066578 2.082544
H 5.730781 1.877883 3.074375
H 5.185026 0.185345 2.850219
H 6.666862 0.778092 2.020212
H 3.870864 -1.314242 1.942409
H 3.290112 0.045279 -2.145636
H 1.379441 -1.562401 -2.395554
H 0.061729 -3.367322 -1.604145
H 0.596796 -4.303054 -0.172340
H 6.937363 -0.774392 -2.136678
H 5.628923 -1.640896 -1.324376
H -0.884225 -3.007181 1.196704
H 6.892293 4.610995 -0.389311
H 7.775340 3.557569 -1.510994
H -4.736108 -0.966730 2.116643
H -2.845328 -1.983776 1.364108
H -3.371999 -0.359356 -1.974484
H -5.340976 1.173404 -2.366001
H -7.002028 1.661001 2.359494
H -7.988005 0.322445 1.747822
H -6.706468 -0.002426 2.958821


