%chk=000267771.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000267771

0 1
Cl 4.213556 -2.297279 -0.732579
N 1.057829 1.489873 -0.011530
N -3.073152 -0.584075 -0.479966
N 2.702955 0.558211 -1.335365
N 0.968202 -0.307669 1.750600
N 2.548775 -2.119174 1.297236
C -0.021790 2.434921 0.407013
C -1.394618 1.750130 0.291210
C -1.790428 1.457021 -1.158735
C -3.132203 0.704538 -1.243804
C 0.248119 2.913564 1.832868
C -2.153274 -1.576604 -1.130726
C -4.444084 -1.163001 -0.284582
C 1.421351 0.288311 0.598314
C 1.866655 1.595901 -1.184341
C 2.459167 -0.285632 -0.245547
C -1.643310 -2.561920 -0.077789
C -5.207136 -0.366117 0.775142
C 2.993157 -1.524510 0.174657
C 1.559700 -1.486755 2.036276
H 0.030078 3.308985 -0.297480
H -2.163942 2.380183 0.777012
H -1.406073 0.797132 0.874503
H -0.999344 0.851887 -1.649903
H -1.869486 2.395912 -1.738095
H -3.932674 1.332429 -0.791633
H -3.406605 0.562435 -2.311566
H 1.248604 3.349094 1.940631
H 0.180479 2.086249 2.558984
H -0.479825 3.672581 2.140981
H -2.631262 -2.122450 -1.971747
H -1.283690 -1.030368 -1.564072
H -5.031673 -1.209298 -1.226622
H -4.326959 -2.212965 0.068646
H 1.791784 2.443515 -1.853982
H -1.238304 -2.024982 0.792217
H -2.440064 -3.214074 0.295941
H -0.849391 -3.197176 -0.483303
H -4.598327 -0.244237 1.681889
H -5.468606 0.638722 0.426808
H -6.133244 -0.876207 1.058353
H 1.236552 -2.016598 2.948692


%chk=000267771-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000267771

0 1
Cl 4.508221 -2.103968 -0.591433
N 1.079244 1.563616 0.029530
N -3.083531 -0.678167 -0.575063
N 2.871643 0.771349 -1.194007
N 0.902188 -0.275611 1.694189
N 2.589339 -2.010266 1.330466
C -0.043749 2.464730 0.427975
C -1.410678 1.761658 0.235572
C -1.703725 1.340914 -1.218612
C -3.049008 0.587999 -1.352632
C 0.163695 2.972385 1.870815
C -2.351468 -1.784119 -1.253998
C -4.461089 -1.068225 -0.168309
C 1.448178 0.353740 0.618324
C 1.963752 1.753713 -1.042297
C 2.567851 -0.124543 -0.158896
C -1.845708 -2.860645 -0.274698
C -5.004536 -0.231040 1.005920
C 3.101085 -1.358137 0.275259
C 1.521362 -1.450449 1.993165
H 0.020789 3.322152 -0.272868
H -2.192474 2.467997 0.581098
H -1.471699 0.872386 0.888166
H -0.882033 0.700322 -1.595703
H -1.735810 2.232476 -1.879901
H -3.855572 1.244762 -0.976306
H -3.264356 0.410171 -2.436969
H 1.137930 3.480932 1.979754
H 0.120404 2.132984 2.584861
H -0.633293 3.692274 2.127996
H -2.981911 -2.257360 -2.049705
H -1.478449 -1.345728 -1.771741
H -5.171792 -1.015363 -1.032928
H -4.431234 -2.127479 0.144942
H 1.898938 2.633289 -1.680768
H -1.194762 -2.400256 0.489031
H -2.676377 -3.368234 0.248262
H -1.268622 -3.634396 -0.814455
H -4.329938 -0.317962 1.875554
H -5.091832 0.840280 0.747649
H -6.010436 -0.585343 1.299541
H 1.136962 -2.012333 2.847827


