%chk=000237101.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000237101

0 1
Cl 2.687658 2.434812 -2.025681
Cl -2.688889 -2.433954 -2.028095
O 3.124747 -0.131567 2.248848
O -3.124971 0.127740 2.249037
O 5.504828 1.991210 -1.899693
O -5.505872 -1.987992 -1.902535
N 1.393800 0.346271 -0.007246
N -1.394036 -0.348463 -0.007612
C 0.572298 0.511494 1.228261
C 0.582959 0.508723 -1.247629
C -0.572766 -0.513969 1.227950
C -0.583093 -0.510010 -1.248022
C 2.748519 0.645177 -0.001324
C -2.748871 -0.646191 -0.002097
C 3.566459 0.013203 1.131545
C -3.566598 -0.015194 1.131465
C 3.440100 1.347118 -0.944637
C -3.440842 -1.346669 -0.946278
C 4.952834 -0.389744 0.765226
C -4.952528 0.389381 0.765294
C 5.607809 0.223962 -0.317020
C -5.607726 -0.222466 -0.317874
C 4.905901 1.274499 -1.129954
C -4.906464 -1.272653 -1.131882
C 5.613937 -1.357799 1.527598
C -5.613008 1.357089 1.528649
C 6.918910 -0.135018 -0.633769
C -6.918420 0.138033 -0.634564
C 6.925752 -1.725489 1.197645
C -6.924408 1.726309 1.198762
C 7.575383 -1.116570 0.122979
C -7.574256 1.119246 0.123175
H 0.166025 1.548683 1.279463
H 1.195205 0.362894 2.146915
H 1.210072 0.297480 -2.145187
H 0.184549 1.545090 -1.339894
H -0.166445 -1.551180 1.278783
H -1.195851 -0.365847 2.146555
H -1.210090 -0.298163 -2.145526
H -0.184761 -1.546356 -1.340893
H 5.105982 -1.818030 2.379176
H -5.104912 1.815842 2.380934
H 7.425620 0.358451 -1.469261
H -7.425317 -0.354000 -1.470788
H 7.438160 -2.485929 1.788101
H -7.436330 2.486477 1.789984
H 8.598429 -1.398779 -0.130063
H -8.596981 1.402653 -0.129823


%chk=000237101-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000237101

0 1
Cl 2.857286 2.481455 -2.236877
Cl -2.857559 -2.479408 -2.239609
O 2.654415 -1.203582 1.473446
O -2.654138 1.201765 1.474496
O 5.706786 1.683921 -2.071605
O -5.706888 -1.681417 -2.073746
N 1.322668 0.568473 -0.244096
N -1.322671 -0.568856 -0.244729
C 0.506166 0.580651 0.996791
C 0.495580 0.601556 -1.468881
C -0.506265 -0.582186 0.996210
C -0.495472 -0.600843 -1.469467
C 2.709448 0.496231 -0.257360
C -2.709430 -0.496237 -0.258064
C 3.367822 -0.464806 0.723594
C -3.367662 0.463955 0.723804
C 3.534940 1.188790 -1.149131
C -3.535006 -1.187687 -1.150614
C 4.851950 -0.565635 0.734077
C -4.851765 0.565159 0.734227
C 5.635503 0.126588 -0.227142
C -5.635396 -0.125879 -0.227780
C 4.997074 1.038391 -1.233472
C -4.997085 -1.036777 -1.235005
C 5.481275 -1.400340 1.691395
C -5.480979 1.399047 1.692331
C 7.041093 -0.024067 -0.229303
C -7.040949 0.025130 -0.229932
C 6.883556 -1.543028 1.689486
C -6.883224 1.542093 1.690421
C 7.663902 -0.854573 0.727009
C -7.663645 0.854820 0.727162
H -0.053393 1.535578 1.030915
H 1.154357 0.508266 1.879064
H 1.134559 0.524970 -2.360729
H -0.075066 1.548510 -1.528632
H 0.053279 -1.537154 1.029477
H -1.154527 -0.510626 1.878499
H -1.134354 -0.523454 -2.361314
H 0.075172 -1.547746 -1.529997
H 4.854348 -1.929828 2.415418
H -4.853997 1.927638 2.416961
H 7.618327 0.521078 -0.982225
H -7.618240 -0.519095 -0.983476
H 7.369626 -2.188904 2.427983
H -7.369206 2.187339 2.429525
H 8.753262 -0.967194 0.724870
H -8.752976 0.967724 0.725020


