%chk=000180184.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000180184

0 1
Cl -0.629887 -7.546860 -1.129664
O -1.935062 0.502440 -0.029254
O -2.460898 -0.438877 2.000485
O 3.301121 2.920193 0.942972
N -3.037315 -1.457797 -0.029482
N -3.075445 3.613623 0.382878
C -3.710306 -2.653787 0.555379
C -5.190666 -2.703827 0.123600
C -2.945816 -3.889254 0.111272
C -6.024816 -1.641303 0.828677
C -2.141472 -4.563069 1.043533
C -3.018761 -4.353670 -1.210489
C -2.496402 -0.492048 0.788576
C -1.360249 1.649466 0.670342
C -1.421495 -5.699257 0.666236
C -2.302885 -5.487731 -1.602412
C -0.046366 1.938812 -0.022857
C -1.514928 -6.144493 -0.654399
C 1.072489 2.251278 0.753901
C 0.040801 1.890160 -1.421249
C 2.277413 2.525805 0.087936
C 1.257524 2.164174 -2.054076
C 2.392046 2.489853 -1.307414
C -2.318290 2.752632 0.508405
C 4.634497 2.698278 0.578607
C 5.069527 1.528588 -0.052382
C 5.512656 3.706044 1.001958
C 6.442369 1.372614 -0.265955
C 6.877841 3.519876 0.780480
C 7.342808 2.360976 0.145299
H -3.665574 -2.559833 1.680503
H -5.592576 -3.712884 0.353705
H -5.285241 -2.588906 -0.973832
H -2.983607 -1.369963 -1.040807
H -6.002299 -1.757533 1.919539
H -7.075300 -1.690923 0.517806
H -5.667278 -0.627519 0.606209
H -2.069988 -4.199792 2.070607
H -3.637249 -3.834500 -1.942099
H -1.234406 1.393515 1.761674
H -0.796624 -6.226489 1.387610
H -2.357417 -5.853414 -2.627722
H 1.037725 2.292529 1.841543
H -0.842019 1.631981 -2.006745
H 1.320997 2.129892 -3.142571
H 3.335654 2.722823 -1.797178
H 4.364111 0.757668 -0.352725
H 5.125546 4.596121 1.493316
H 6.810733 0.469711 -0.753280
H 7.585134 4.284663 1.102083
H 8.409243 2.228612 -0.025638


%chk=000180184-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000180184

0 1
Cl 2.510670 -4.433473 -1.177785
O -2.946959 1.325102 -0.341885
O -2.310994 0.409221 1.748068
O 2.424167 1.864323 1.101290
N -3.158530 -0.915059 -0.002269
N -3.887812 4.544358 -0.890904
C -2.969809 -2.233356 0.660640
C -4.207928 -3.127806 0.420305
C -1.630663 -2.849644 0.218852
C -5.487421 -2.562230 1.069531
C -0.433075 -2.377665 0.819076
C -1.536874 -3.826574 -0.803414
C -2.764395 0.257450 0.582205
C -2.336794 2.625638 0.114375
C 0.830272 -2.852825 0.405920
C -0.281208 -4.316800 -1.230812
C -0.883798 2.702006 -0.337992
C 0.883007 -3.815449 -0.620772
C 0.120746 2.264981 0.557022
C -0.537742 3.125538 -1.644568
C 1.463797 2.237122 0.130388
C 0.814054 3.100143 -2.051495
C 1.825042 2.654296 -1.172294
C -3.196838 3.679175 -0.450049
C 3.512193 1.019108 0.750941
C 3.396158 -0.013916 -0.208609
C 4.699757 1.199444 1.492585
C 4.498464 -0.870962 -0.427915
C 5.792286 0.334795 1.261977
C 5.698828 -0.699854 0.300837
H -2.905029 -2.005569 1.740591
H -3.989687 -4.132686 0.828983
H -4.373386 -3.261258 -0.668786
H -3.423649 -0.888802 -0.989390
H -5.378832 -2.494917 2.167759
H -6.357540 -3.207829 0.854518
H -5.712300 -1.548690 0.692409
H -0.488717 -1.622197 1.611498
H -2.440152 -4.221710 -1.279949
H -2.396238 2.644081 1.220067
H 1.748407 -2.481871 0.870919
H -0.212560 -5.070661 -2.020359
H -0.129744 1.923562 1.566032
H -1.315407 3.474056 -2.332736
H 1.087627 3.435874 -3.057248
H 2.874077 2.640435 -1.484230
H 2.463703 -0.154636 -0.764764
H 4.747857 2.003163 2.233282
H 4.408233 -1.680835 -1.160096
H 6.716561 0.471178 1.834027
H 6.547772 -1.369179 0.127124


