%chk=000217762.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000217762

0 1
Cl 5.487969 0.297513 0.184199
N -2.547817 -3.409541 1.208236
C -0.479121 -0.583983 -0.095686
C -1.107133 -1.383196 1.079293
C -0.730454 -1.485900 -1.343248
C -2.298522 -2.144053 0.456299
C -1.877296 -2.451092 -1.001638
C 1.025439 -0.365471 0.017744
C -1.193085 0.766276 -0.151915
C 1.810571 -1.048773 0.956095
C 1.649720 0.521746 -0.879883
C -0.795730 1.784906 0.733503
C -2.266263 1.005825 -1.019703
C 3.193220 -0.849329 1.016343
C 3.028005 0.732163 -0.834917
C -1.448148 3.018308 0.735505
C -2.919516 2.243310 -1.016618
C 3.780658 0.041310 0.118489
C -2.512734 3.253034 -0.142169
H -1.415976 -0.731967 1.910062
H -0.379398 -2.107837 1.500119
H 0.184658 -2.060025 -1.582345
H -0.947328 -0.885765 -2.241052
H -3.197753 -1.476405 0.448591
H -2.725657 -2.340396 -1.693749
H -1.533961 -3.499800 -1.092752
H -3.306064 -3.937621 0.788076
H -2.811874 -3.213847 2.168710
H 1.342499 -1.755179 1.647982
H 1.048643 1.057557 -1.616528
H 0.032023 1.613419 1.421925
H -2.605505 0.229585 -1.704319
H 3.798666 -1.381695 1.749063
H 3.508953 1.421262 -1.528299
H -1.127552 3.800203 1.422164
H -3.749337 2.416551 -1.699662
H -3.019599 4.215306 -0.141217


%chk=000217762-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000217762

0 1
Cl 5.674897 0.468436 0.063617
N -2.768896 -3.288439 1.221115
C -0.420432 -0.653665 -0.089338
C -1.001734 -1.525948 1.068495
C -0.713142 -1.592782 -1.314931
C -2.345220 -2.057803 0.513953
C -2.048349 -2.334543 -0.994720
C 1.091247 -0.369730 0.010173
C -1.191207 0.691400 -0.143886
C 1.924498 -0.933205 1.008210
C 1.697590 0.466879 -0.966648
C -0.970032 1.646411 0.885972
C -2.124901 1.016168 -1.159131
C 3.317318 -0.682844 1.034475
C 3.083814 0.724966 -0.963891
C -1.658079 2.877136 0.904268
C -2.814901 2.251693 -1.149008
C 3.877011 0.140301 0.042805
C -2.587621 3.187686 -0.116991
H -1.110816 -0.968906 2.017040
H -0.356129 -2.407016 1.246347
H 0.113203 -2.322898 -1.381340
H -0.729523 -1.047195 -2.275090
H -3.101950 -1.241987 0.584770
H -2.880138 -1.990698 -1.635928
H -1.932967 -3.423767 -1.142147
H -3.581955 -3.742914 0.788186
H -2.925876 -3.144021 2.226014
H 1.500097 -1.574838 1.786124
H 1.073201 0.935360 -1.736020
H -0.237978 1.425805 1.672573
H -2.324399 0.308188 -1.970108
H 3.948732 -1.121376 1.812885
H 3.536545 1.369378 -1.723125
H -1.465449 3.596689 1.708321
H -3.530063 2.479788 -1.947875
H -3.121198 4.144689 -0.108467


