%chk=000250931.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000250931

0 1
Cl 1.122402 4.193081 -1.384497
O 5.083409 -2.029502 -0.814406
O -4.792561 -2.329412 -0.693522
O -0.796812 -0.567979 1.420012
N 3.133288 -0.407285 0.503882
N -3.232445 -0.129410 0.238047
C 1.916827 -0.184407 1.355566
C -2.838189 1.316341 0.346436
C 4.184265 -1.141421 1.285163
C 2.785397 -1.184320 -0.731994
C -3.103456 -0.624476 -1.173101
C -4.631458 -0.346373 0.735446
C 0.975859 0.787649 0.691572
C -1.346215 1.476090 0.196916
C 5.422879 -1.315163 0.391234
C 4.056793 -1.359406 -1.575866
C -3.459681 -2.118125 -1.202875
C -4.949177 -1.848985 0.655365
C -0.425517 0.568659 0.763329
C 1.444846 1.920660 0.029154
C -0.848775 2.601732 -0.476689
C 0.526724 2.803295 -0.551113
H 2.245337 0.255845 2.326951
H 1.377156 -1.129607 1.605830
H -3.376543 1.962330 -0.383083
H -3.127384 1.684084 1.361099
H 3.841396 -2.134036 1.648567
H 4.447821 -0.533681 2.176593
H 2.027447 -0.606056 -1.303490
H 2.340122 -2.177205 -0.507233
H -3.752689 -0.066441 -1.881896
H -2.052391 -0.472439 -1.504493
H -5.385792 0.227696 0.154585
H -4.693746 -0.001943 1.789603
H 5.869179 -0.342452 0.118419
H 6.181046 -1.972093 0.851396
H 3.904460 -2.047801 -2.424859
H 4.449707 -0.390421 -1.931189
H -2.748168 -2.725582 -0.616221
H -3.535777 -2.508680 -2.233440
H -6.013921 -2.060248 0.860828
H -4.305169 -2.442622 1.327895
H 2.522169 2.102905 -0.042267
H -1.531998 3.317682 -0.934170
H -1.800563 -0.765479 1.296713


%chk=000250931-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000250931

0 1
Cl 1.284151 4.161255 -1.513172
O 5.450437 -1.821641 -0.727051
O -5.023512 -2.292757 -0.555674
O -1.022727 -0.647301 1.295915
N 3.148616 -0.528302 0.484359
N -3.318827 -0.088223 0.263739
C 1.834448 -0.440823 1.165758
C -2.865399 1.344822 0.337504
C 4.181220 -1.197094 1.315509
C 3.053076 -1.182517 -0.846842
C -3.286056 -0.621890 -1.136367
C -4.669625 -0.290269 0.869253
C 0.919331 0.609367 0.549714
C -1.364614 1.467333 0.113042
C 5.535950 -1.165181 0.588274
C 4.421802 -1.154459 -1.544366
C -3.681774 -2.106001 -1.133669
C -5.045560 -1.780938 0.822991
C -0.492204 0.472120 0.656363
C 1.448996 1.743996 -0.106544
C -0.817724 2.584455 -0.555723
C 0.580403 2.705637 -0.650521
H 2.023320 -0.174160 2.225444
H 1.294295 -1.416547 1.185974
H -3.426032 1.980533 -0.381722
H -3.118460 1.695577 1.358879
H 3.911701 -2.261628 1.532740
H 4.268338 -0.662542 2.280903
H 2.312277 -0.639242 -1.462000
H 2.709163 -2.243380 -0.749449
H -3.990129 -0.047212 -1.778444
H -2.264505 -0.496774 -1.537820
H -5.433468 0.304624 0.319673
H -4.642835 0.058496 1.918402
H 5.862371 -0.110314 0.459460
H 6.302348 -1.726015 1.148574
H 4.397082 -1.709686 -2.496506
H 4.720226 -0.100536 -1.733979
H -2.935751 -2.695950 -0.558406
H -3.744323 -2.497914 -2.161292
H -6.075606 -1.936575 1.181941
H -4.342040 -2.366304 1.454350
H 2.536780 1.833990 -0.185951
H -1.472689 3.350198 -0.985183
H -2.052372 -0.655228 1.036118


