%chk=000248727.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000248727

0 1
Cl -6.817169 -3.720031 2.008168
S -1.227059 -0.185785 1.001718
O 1.135260 -1.634422 -0.015904
N -0.576531 2.868162 0.475873
N 2.568278 0.160241 -0.198337
N 2.786973 1.484428 -0.192475
C -1.710588 4.904540 -1.331783
C -2.128136 3.430639 -1.403331
C -0.296349 5.045492 -0.753878
C -1.969400 2.727642 -0.043336
C -0.185157 4.306446 0.588977
C 0.392166 1.903959 0.234137
C 0.197023 0.532449 0.320280
C 1.783989 2.316651 -0.006730
C 1.242843 -0.427443 0.053390
C -1.768025 -1.405358 -0.251466
C 3.761264 -0.660517 -0.393637
C -3.024540 -1.976671 0.307225
C 3.663056 -1.839623 -1.150464
C 4.985302 -0.264988 0.172428
C -4.274770 -1.556356 -0.177792
C -2.962755 -2.942387 1.328430
C 4.804256 -2.623321 -1.334764
C 6.115474 -1.059715 -0.030811
C 6.029127 -2.236781 -0.781264
C -5.453654 -2.094007 0.344840
C -4.133969 -3.484758 1.859968
C -5.362875 -3.050872 1.357114
H -1.754152 5.359312 -2.339876
H -2.431200 5.471833 -0.711044
H -3.180278 3.348112 -1.736583
H -1.525037 2.904752 -2.169565
H 0.445141 4.646102 -1.473480
H -0.042896 6.113492 -0.615710
H -2.651777 3.174014 0.715441
H -2.266175 1.660206 -0.136735
H 0.836850 4.401794 1.014834
H -0.872408 4.764978 1.339235
H 2.043296 3.382850 -0.042830
H -0.970674 -2.174556 -0.380141
H -1.901798 -0.925969 -1.235702
H 2.704375 -2.154854 -1.568532
H 5.056499 0.652038 0.757065
H -4.330480 -0.806973 -0.965549
H -1.992615 -3.266236 1.711314
H 4.734413 -3.543436 -1.914501
H 7.068726 -0.759097 0.402572
H 6.913456 -2.852837 -0.931917
H -6.424731 -1.772787 -0.029401
H -4.090670 -4.231549 2.652432


%chk=000248727-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000248727

0 1
Cl -5.245606 -5.552239 2.339133
S -1.740126 0.388486 0.790922
O 0.541471 -1.542523 0.281160
N -0.440662 3.263459 -0.068016
N 2.261660 0.031396 -0.108454
N 2.705983 1.335960 -0.182011
C -1.461407 5.740110 -1.269238
C -1.878983 4.343242 -1.782997
C -0.054701 5.680536 -0.629165
C -1.794928 3.269186 -0.669084
C -0.016232 4.583352 0.458183
C 0.369885 2.134138 0.004929
C -0.063739 0.796659 0.187276
C 1.808363 2.313188 -0.126452
C 0.875677 -0.323613 0.120872
C -2.358299 -0.923946 -0.498748
C 3.326857 -0.955713 -0.173089
C -3.074377 -2.049385 0.200512
C 3.099528 -2.261045 -0.676286
C 4.626031 -0.573040 0.246467
C -4.485256 -2.169279 0.135428
C -2.332847 -3.013859 0.935920
C 4.175220 -3.172817 -0.749245
C 5.689646 -1.494621 0.167827
C 5.471677 -2.800904 -0.328491
C -5.156829 -3.232499 0.782962
C -2.987383 -4.080529 1.586299
C -4.391575 -4.171701 1.497710
H -1.481522 6.476218 -2.094125
H -2.192836 6.087095 -0.510146
H -2.915354 4.366541 -2.171484
H -1.218918 4.042534 -2.620302
H 0.702514 5.457925 -1.406481
H 0.209224 6.654805 -0.175074
H -2.556374 3.469731 0.113983
H -2.009682 2.272830 -1.080929
H 0.981049 4.501367 0.918745
H -0.720019 4.863518 1.273264
H 2.236562 3.311014 -0.253974
H -1.441581 -1.272352 -0.994954
H -3.008138 -0.384549 -1.206428
H 2.099669 -2.563483 -0.986347
H 4.788792 0.441125 0.617952
H -5.071211 -1.431274 -0.425573
H -1.244642 -2.905599 0.996823
H 3.992277 -4.180469 -1.138268
H 6.688851 -1.191355 0.499361
H 6.298620 -3.517161 -0.384043
H -6.245352 -3.326004 0.730961
H -2.419081 -4.825656 2.150621


