%chk=000258601.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000258601

0 1
Cl 8.860204 -0.623047 0.115220
O -7.741577 -0.958195 1.767922
N -1.586241 0.708746 -0.047696
N 0.305224 1.984337 0.287604
N 3.098253 0.771444 0.159570
N -0.445880 -1.511177 -0.420542
N 1.994617 -1.334930 -0.297467
C -2.981028 0.396854 -0.190698
C -0.490582 -0.160908 -0.165246
C 0.678552 0.653625 0.040868
C -5.709820 -0.174446 -0.445158
C -3.864743 1.398360 -0.633171
C -3.453423 -0.891014 0.113388
C -7.175136 -0.476422 -0.565316
C -1.028584 2.006261 0.233567
C -5.223024 1.106703 -0.751599
C -4.814353 -1.166883 -0.017161
C 1.958137 0.010163 -0.035140
C -7.951293 -0.043600 0.686396
C 4.466882 0.357276 0.132755
C 0.811057 -2.014470 -0.473311
C 5.419108 1.373026 0.388864
C 4.887646 -0.957960 -0.127633
C 6.777734 1.068046 0.383010
C 6.250992 -1.258533 -0.132202
C 7.177887 -0.246266 0.122172
H -3.501246 2.390176 -0.897014
H -2.763340 -1.677899 0.434716
H -7.341178 -1.563660 -0.731565
H -7.603206 0.018105 -1.461386
H -1.658903 2.871898 0.390478
H -5.909028 1.882053 -1.092683
H -5.179495 -2.169960 0.210402
H 2.931807 1.771572 0.351774
H -9.045614 -0.104332 0.528634
H -7.676598 0.974652 1.014633
H 0.911838 -3.095094 -0.679043
H 5.102365 2.395218 0.591826
H 4.163474 -1.755827 -0.327928
H 7.519323 1.843515 0.579266
H 6.585402 -2.277719 -0.333517
H -6.792212 -0.993788 2.006511


%chk=000258601-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000258601

0 1
Cl 8.988305 -0.594434 0.259072
O -7.446076 -1.126812 1.850028
N -1.571363 0.718086 -0.131994
N 0.344007 1.966075 0.168602
N 3.076264 0.714447 0.117923
N -0.490582 -1.535888 -0.399810
N 1.964962 -1.402143 -0.258871
C -2.974569 0.432876 -0.266652
C -0.487316 -0.183400 -0.201710
C 0.672123 0.614262 -0.023052
C -5.766206 -0.106932 -0.497872
C -3.873731 1.467547 -0.628089
C -3.462233 -0.877798 -0.045832
C -7.258837 -0.383511 -0.545759
C -0.997089 1.987712 0.098225
C -5.251968 1.195461 -0.729697
C -4.844238 -1.134123 -0.164664
C 1.938181 -0.044626 -0.056444
C -7.933810 -0.182891 0.840245
C 4.445315 0.345724 0.138886
C 0.770835 -2.055761 -0.416349
C 5.392538 1.387321 0.344218
C 4.900740 -0.990062 -0.031590
C 6.772595 1.108020 0.381147
C 6.283145 -1.268824 0.005684
C 7.201961 -0.222776 0.210982
H -3.506300 2.473383 -0.856006
H -2.760266 -1.682670 0.184947
H -7.446495 -1.423684 -0.869610
H -7.756487 0.287661 -1.272265
H -1.603818 2.877817 0.238646
H -5.936328 2.004169 -1.012550
H -5.210707 -2.156770 -0.018541
H 2.875088 1.710650 0.258023
H -9.013863 -0.390540 0.764561
H -7.796335 0.867393 1.176437
H 0.842353 -3.135742 -0.573958
H 5.052837 2.422149 0.476366
H 4.169547 -1.784448 -0.189290
H 7.497554 1.911402 0.539211
H 6.636389 -2.295837 -0.124666
H -6.472125 -0.986586 1.976167


