%chk=000181717.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000181717

0 1
Cl 7.274843 -2.651109 -1.606406
O -2.010138 1.115769 0.066618
O -4.448420 1.600262 -0.479426
O 3.988490 2.113104 1.722139
N -5.102810 -0.543231 -0.941681
C -7.054374 -1.945471 0.745740
C -7.221882 -0.460913 0.396234
C -5.577271 -2.363105 0.709370
C -6.535620 -0.114417 -0.934805
C -4.941695 -1.991867 -0.641955
C -4.155508 0.424395 -0.536955
C -2.725759 -0.084172 -0.333796
C -0.656414 1.015315 0.257265
C 0.113498 -0.146024 0.098223
C -0.080825 2.245347 0.652038
C 2.084631 1.141218 0.712583
C 1.488923 -0.066593 0.330156
C 1.283282 2.293327 0.884655
C 3.538909 1.254538 0.990333
C 4.452370 0.262989 0.328646
C 4.348493 -0.001326 -1.044182
C 5.446790 -0.359504 1.097081
C 5.225854 -0.902552 -1.652269
C 6.323839 -1.271010 0.503311
C 6.196076 -1.526929 -0.863867
H -7.476981 -2.145385 1.748910
H -7.638705 -2.566722 0.039575
H -8.295281 -0.199547 0.339622
H -6.800923 0.168885 1.205793
H -5.029273 -1.872916 1.537014
H -5.484099 -3.451444 0.882140
H -7.040376 -0.619138 -1.786491
H -6.586100 0.984262 -1.124884
H -3.875369 -2.288575 -0.674645
H -5.442020 -2.555240 -1.465364
H -2.298295 -0.473399 -1.276011
H -2.652163 -0.827426 0.479352
H -0.329381 -1.090383 -0.194225
H -0.720250 3.120489 0.767280
H 2.099281 -0.966351 0.217784
H 1.759293 3.225741 1.207530
H 3.586458 0.502680 -1.642096
H 5.537793 -0.122368 2.160155
H 5.158245 -1.111590 -2.719579
H 7.096566 -1.764612 1.092588


%chk=000181717-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000181717

0 1
Cl 7.487596 -3.032249 -1.342220
O -2.018771 1.458999 0.130026
O -4.641012 1.905780 -0.107540
O 4.196032 2.234620 1.440479
N -5.202648 -0.335346 -0.425575
C -7.220724 -2.340035 0.261885
C -7.502570 -0.825574 0.405230
C -5.709598 -2.628149 0.422438
C -6.640797 -0.007512 -0.581039
C -4.877013 -1.772100 -0.563563
C -4.292526 0.695317 -0.205319
C -2.813707 0.255959 -0.085063
C -0.637395 1.303626 0.265761
C 0.053327 0.064908 0.213405
C 0.079312 2.512552 0.478924
C 2.188388 1.248206 0.559333
C 1.456707 0.049199 0.354706
C 1.469456 2.478096 0.634096
C 3.665333 1.277477 0.788313
C 4.546807 0.178794 0.253245
C 4.274458 -0.508801 -0.959763
C 5.747599 -0.113509 0.954153
C 5.170886 -1.480418 -1.456233
C 6.643235 -1.092955 0.482711
C 6.336144 -1.765406 -0.718471
H -7.801183 -2.915458 1.006621
H -7.554191 -2.682001 -0.740135
H -8.571054 -0.609927 0.215672
H -7.278382 -0.497613 1.438801
H -5.394685 -2.395206 1.458689
H -5.494122 -3.698814 0.242116
H -6.946530 -0.234843 -1.624593
H -6.747717 1.076840 -0.418457
H -3.801603 -1.940975 -0.395949
H -5.102806 -2.091965 -1.603947
H -2.485521 -0.255810 -1.013993
H -2.686651 -0.442094 0.768895
H -0.480406 -0.879755 0.075622
H -0.483842 3.449202 0.520892
H 1.978445 -0.913320 0.344535
H 2.034547 3.396689 0.821210
H 3.380541 -0.263239 -1.541761
H 5.968181 0.446893 1.868266
H 4.971416 -1.998089 -2.398774
H 7.560745 -1.326991 1.029869


