%chk=000220759.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000220759

0 1
Cl -8.111632 0.275513 0.022690
N -2.181301 0.506444 0.000295
N 2.475059 -0.251415 -0.027387
N -1.536592 1.734135 0.010044
N -1.415846 -1.893720 -0.027131
N 1.019095 -2.122544 -0.039515
C 0.060146 0.105875 -0.013260
C -1.232431 -0.531873 -0.014244
C 1.200414 -0.750540 -0.026624
C 3.664706 -1.146220 -0.041049
C -3.619591 0.440570 0.005683
C -0.209471 1.517030 0.002229
C 4.915117 -0.306752 -0.017031
C -4.269283 -0.806812 -0.004205
C -4.363143 1.639502 0.020936
C -0.260368 -2.609216 -0.039026
C 5.509792 0.102599 -1.219255
C 5.486203 0.067900 1.207782
C -5.664504 -0.854478 0.001118
C -5.755669 1.585722 0.026195
C -6.388487 0.339132 0.016199
C 6.672551 0.877661 -1.194180
C 6.648925 0.843105 1.227530
C 7.243095 1.248357 0.027877
H 3.623756 -1.805376 -0.943286
H 3.616159 -1.843699 0.831735
H 2.636092 0.750384 -0.017931
H 0.509966 2.321258 0.007337
H -3.701524 -1.745098 -0.016084
H -3.854243 2.607790 0.028647
H -0.356847 -3.709386 -0.049576
H 5.068946 -0.184813 -2.173249
H 5.026802 -0.246651 2.144332
H -6.179261 -1.816501 -0.006472
H -6.342500 2.505148 0.037959
H 7.135401 1.192044 -2.128901
H 7.093373 1.130585 2.179686
H 8.150195 1.850940 0.045330


%chk=000220759-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000220759

0 1
Cl -8.242429 0.260708 0.013861
N -2.189240 0.500599 0.003764
N 2.475717 -0.264901 -0.019207
N -1.571197 1.768048 0.019348
N -1.437914 -1.872108 -0.029752
N 1.008469 -2.101297 -0.038880
C 0.044939 0.127281 -0.006772
C -1.233296 -0.516592 -0.012250
C 1.191199 -0.737996 -0.021492
C 3.660567 -1.157204 -0.035674
C -3.619631 0.427200 0.006003
C -0.236960 1.531727 0.012824
C 4.935943 -0.329600 -0.016176
C -4.276665 -0.829358 -0.011151
C -4.368495 1.630454 0.025522
C -0.273951 -2.578111 -0.041743
C 5.546729 0.082589 -1.228190
C 5.523620 0.060321 1.214623
C -5.686578 -0.876836 -0.008693
C -5.776648 1.579055 0.027963
C -6.417925 0.325173 0.010801
C 6.720800 0.869356 -1.211889
C 6.697499 0.847121 1.234746
C 7.298155 1.254266 0.020582
H 3.611069 -1.799233 -0.934535
H 3.606449 -1.835272 0.835891
H 2.638486 0.742408 -0.008983
H 0.440827 2.384245 0.022690
H -3.685467 -1.748230 -0.026119
H -3.843305 2.587533 0.038538
H -0.372075 -3.667835 -0.055487
H 5.105180 -0.221191 -2.185286
H 5.064238 -0.260968 2.157504
H -6.203081 -1.840796 -0.021949
H -6.362940 2.502043 0.043066
H 7.185876 1.176336 -2.155124
H 7.144705 1.136759 2.192013
H 8.210427 1.860906 0.034810


