%chk=000223734.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000223734

0 1
Cl 0.976881 -3.866934 0.241127
N -1.364176 0.693903 -0.010966
N 3.352833 0.505667 -0.006520
N -0.872077 1.986779 -0.082967
N -0.319412 -1.592691 0.118324
N 2.138162 -1.523849 0.114688
C 0.910537 0.566878 -0.000783
C -0.298513 -0.218118 0.042121
C 2.149247 -0.140787 0.037171
C 4.646735 -0.228626 0.046384
C 5.804918 0.687669 -0.362986
C -2.787499 0.451061 -0.006465
C 0.472652 1.932067 -0.077876
C 6.179570 1.695976 0.717901
C -3.279581 -0.842804 0.229941
C -3.667891 1.525465 -0.239935
C 0.919888 -2.148682 0.147145
C -4.660844 -1.053571 0.228013
C -5.042834 1.290843 -0.234757
C -5.543741 0.004980 -0.002347
H 4.590104 -1.117976 -0.629144
H 4.794204 -0.634734 1.074881
H 3.383818 1.518998 -0.036760
H 6.685452 0.051390 -0.596808
H 5.569475 1.211842 -1.311699
H 1.088444 2.816357 -0.126131
H 6.472228 1.198239 1.651353
H 7.028541 2.315723 0.402818
H 5.354896 2.374773 0.959418
H -2.605612 -1.686937 0.410814
H -3.282133 2.531063 -0.420671
H -5.047042 -2.056961 0.409028
H -5.729235 2.118059 -0.414313
H -6.617894 -0.169560 -0.001296


%chk=000223734-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000223734

0 1
Cl 0.945542 -3.956060 0.185430
N -1.340520 0.676679 0.020256
N 3.380495 0.443515 0.142863
N -0.868266 2.006009 -0.005404
N -0.322500 -1.591542 0.104008
N 2.122011 -1.543334 0.167186
C 0.922298 0.561047 0.078481
C -0.277238 -0.220301 0.070389
C 2.158905 -0.169173 0.131490
C 4.664348 -0.283189 0.210943
C 5.821359 0.568641 -0.349766
C -2.758059 0.441020 -0.007653
C 0.483678 1.922784 0.029555
C 6.105407 1.858801 0.454063
C -3.268781 -0.880971 0.022382
C -3.632897 1.554204 -0.065227
C 0.906715 -2.135653 0.145906
C -4.666313 -1.076076 -0.005742
C -5.025388 1.337177 -0.092540
C -5.551411 0.024189 -0.063020
H 4.547224 -1.221753 -0.356254
H 4.877003 -0.569391 1.261903
H 3.406088 1.463222 0.167073
H 6.728378 -0.064975 -0.344701
H 5.615285 0.816850 -1.409130
H 1.060919 2.846292 0.016488
H 6.295708 1.628650 1.518690
H 6.993659 2.379988 0.055393
H 5.267787 2.582597 0.410743
H -2.581841 -1.728950 0.066354
H -3.213486 2.562202 -0.087635
H -5.060577 -2.097878 0.017691
H -5.700954 2.198516 -0.137117
H -6.634475 -0.137634 -0.084395


