%chk=000257444.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000257444

0 1
Cl 5.425695 0.435011 1.470675
O -2.158986 -0.550231 2.309698
O -3.669441 0.677641 -1.867037
O 0.328630 -1.053967 -0.990850
N -2.793579 0.367109 0.267861
N -0.642372 1.388709 -0.090105
C -2.040761 1.646684 0.369038
C -3.478287 -1.870873 0.703228
C -3.975664 -1.463865 -0.690639
C 0.297447 1.120516 1.047368
C -2.719804 -0.673179 1.249784
C -3.496701 -0.038325 -0.915127
C 1.529725 0.394241 0.570635
C -0.140387 2.448573 -1.007560
C 1.480184 -0.655681 -0.368671
C 2.771198 0.729880 1.134919
C 2.641384 -1.391836 -0.732050
C 3.904140 0.011042 0.768555
C 3.859411 -1.045830 -0.147642
C 2.545854 -2.512402 -1.710090
H -2.104459 1.999224 1.427348
H -2.550714 2.393240 -0.291032
H -2.811064 -2.756579 0.668129
H -4.306483 -2.148474 1.383902
H -5.078271 -1.518317 -0.778341
H -3.579972 -2.126913 -1.486467
H -0.226113 0.464821 1.795049
H 0.576831 2.049733 1.591937
H 0.876247 2.178795 -1.347537
H -0.091603 3.452848 -0.561924
H -0.782890 2.487056 -1.904449
H 2.846471 1.541022 1.858958
H 4.768715 -1.590232 -0.403183
H 3.375964 -2.506360 -2.427960
H 2.554189 -3.484661 -1.196176
H 1.608042 -2.464591 -2.288905
H -0.406777 -0.350728 -0.886541


%chk=000257444-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000257444

0 1
Cl 5.613795 0.370531 1.510452
O -2.368417 -0.513929 2.463804
O -3.419828 0.504457 -1.986089
O 0.277412 -0.871985 -0.992287
N -2.752278 0.253036 0.263007
N -0.617120 1.391538 -0.081521
C -2.029157 1.531819 0.356753
C -3.646346 -1.887224 0.800344
C -3.948038 -1.576372 -0.686735
C 0.345033 1.154832 1.055977
C -2.855511 -0.684617 1.321053
C -3.376797 -0.179370 -0.937763
C 1.607144 0.446843 0.582981
C -0.172058 2.456624 -1.021855
C 1.506852 -0.590287 -0.393647
C 2.864607 0.743722 1.155383
C 2.645486 -1.352565 -0.779297
C 3.983913 -0.011070 0.766529
C 3.890879 -1.049551 -0.180522
C 2.498557 -2.452482 -1.807870
H -2.102844 1.875241 1.405831
H -2.544125 2.242580 -0.309972
H -3.039104 -2.797351 0.939779
H -4.557338 -2.009330 1.411357
H -5.024212 -1.580009 -0.928130
H -3.457111 -2.282261 -1.378742
H -0.187642 0.518637 1.789761
H 0.597977 2.110743 1.562942
H 0.851768 2.227176 -1.360854
H -0.167236 3.462779 -0.550945
H -0.837909 2.466527 -1.900799
H 2.961560 1.541119 1.899764
H 4.782158 -1.619541 -0.461325
H 3.476021 -2.893226 -2.067194
H 1.838298 -3.257462 -1.434806
H 2.023277 -2.067152 -2.728154
H -0.325866 -0.039320 -0.772415


