%chk=000243139.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000243139

0 1
Cl 6.511931 -0.420179 0.077089
N -2.572317 -1.304603 0.252451
N -2.216149 1.056834 -0.161460
N -4.512434 0.186073 -0.006465
N -4.787545 -2.135874 0.338003
N -4.094927 2.487018 -0.343202
C 2.057943 0.243895 -0.067411
C 0.607884 0.487351 -0.108251
C 2.614117 -0.931717 -0.600963
C 2.899834 1.215292 0.505899
C -0.308755 -0.468851 0.104616
C -1.759733 -0.216698 0.061318
C 3.994601 -1.141919 -0.561342
C 4.279607 1.012360 0.557756
C 4.805564 -0.165811 0.020804
C -3.942124 -1.060567 0.200126
C -3.600022 1.214526 -0.175589
H 0.308935 1.523976 -0.319490
H 1.966783 -1.682367 -1.056441
H 2.472914 2.129462 0.919832
H -0.038881 -1.506785 0.333800
H 4.430107 -2.050884 -0.976296
H 4.935334 1.758177 1.006872
H -4.413803 -3.043923 0.566457
H -5.783806 -1.993472 0.386489
H -3.467980 3.247082 -0.554830
H -5.086778 2.633303 -0.445473


%chk=000243139-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000243139

0 1
Cl 6.679011 -0.263592 -0.028126
N -2.655882 -1.355986 -0.042909
N -2.216215 1.038119 0.036553
N -4.524434 0.226152 0.012645
N -4.879605 -2.088675 -0.063751
N -4.034487 2.514202 0.087251
C 2.047796 0.186203 -0.000211
C 0.593320 0.389304 0.009748
C 2.660845 -1.101090 -0.048561
C 2.898235 1.329001 0.039564
C -0.374632 -0.577826 -0.020735
C -1.810993 -0.273952 -0.007612
C 4.061167 -1.242898 -0.057057
C 4.302894 1.206207 0.031935
C 4.865079 -0.083696 -0.016739
C -3.999253 -1.038900 -0.030196
C -3.578271 1.221836 0.044595
H 0.239201 1.428815 0.045575
H 2.040647 -2.002685 -0.079966
H 2.449607 2.328540 0.077369
H -0.145134 -1.648274 -0.057325
H 4.523874 -2.233367 -0.094505
H 4.944950 2.090898 0.063066
H -4.512088 -3.035996 -0.097272
H -5.879011 -1.902600 -0.057197
H -3.360238 3.274369 0.112504
H -5.036086 2.687590 0.095655


