%chk=000223228.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000223228

0 1
Cl 6.442380 2.500351 -0.673818
O 1.007322 -0.524001 1.450237
N -1.287346 -0.020807 -0.471713
C -2.015657 1.234671 -0.851908
C 0.175369 0.084434 -0.766597
C -3.323632 1.321509 -0.046570
C -1.898440 -1.228286 -1.118428
C 0.873603 0.572966 0.527056
C -4.072676 2.623902 -0.350248
C -5.379571 2.715943 0.450515
C -1.462904 -2.467771 -0.371685
C 2.278880 1.052249 0.234753
C -6.132297 4.011049 0.155074
C -0.757533 -3.482241 -1.034158
C -1.776266 -2.611234 0.988794
C 3.381310 0.228805 0.505981
C 2.472624 2.330478 -0.310473
C -0.371850 -4.632416 -0.338832
C -1.384847 -3.760524 1.679174
C 4.676764 0.672152 0.228943
C 3.762822 2.784936 -0.595426
C -0.683225 -4.773708 1.016816
C 4.844058 1.944506 -0.321220
H -2.225225 1.300482 -1.940642
H -1.374049 2.108028 -0.601377
H 0.598254 -0.911285 -1.033504
H 0.413473 0.753503 -1.617874
H -3.968008 0.448239 -0.268515
H -3.094746 1.250089 1.035928
H -3.010148 -1.140835 -1.051650
H -1.663547 -1.306640 -2.202174
H 0.277073 1.360416 1.045651
H -3.431008 3.495356 -0.116072
H -4.292708 2.694324 -1.432859
H -6.025995 1.846831 0.218803
H -5.161736 2.649477 1.534812
H -6.398225 4.092314 -0.904926
H -5.535231 4.893591 0.411759
H -7.063004 4.067659 0.731148
H -0.507557 -3.380649 -2.087872
H -2.321008 -1.818427 1.501554
H 0.156606 -1.025031 1.490642
H 3.212464 -0.758813 0.947885
H 1.619910 2.977359 -0.510972
H 0.175633 -5.419114 -0.855666
H -1.626310 -3.867940 2.735678
H 5.538008 0.039232 0.439956
H 3.923074 3.775238 -1.019171
H -0.378978 -5.668266 1.556289


%chk=000223228-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000223228

0 1
Cl 6.894705 0.809049 -0.216208
O 0.281939 0.775110 1.516306
N -1.325080 0.172022 -0.536167
C -2.221282 1.332903 -0.820457
C 0.098985 0.420272 -0.890148
C -3.475576 1.364408 0.076408
C -1.847518 -1.111633 -1.093268
C 0.766292 1.280218 0.237187
C -4.390024 2.574869 -0.222432
C -5.653895 2.603968 0.666897
C -1.226615 -2.348210 -0.454528
C 2.283095 1.194596 0.161166
C -6.570689 3.810167 0.369823
C -0.633109 -3.353870 -1.255569
C -1.262345 -2.527955 0.952154
C 2.995337 0.288463 0.983092
C 2.997874 1.992205 -0.766355
C -0.090013 -4.520301 -0.667640
C -0.720971 -3.689167 1.543285
C 4.398658 0.166148 0.875663
C 4.401090 1.879896 -0.891587
C -0.132588 -4.690813 0.734307
C 5.078193 0.961622 -0.066672
H -2.523284 1.346755 -1.896026
H -1.640134 2.257009 -0.643065
H 0.611297 -0.557172 -0.924547
H 0.222306 0.914231 -1.880156
H -4.062878 0.432808 -0.051381
H -3.150916 1.391133 1.135307
H -2.938660 -1.119488 -0.914589
H -1.705159 -1.153082 -2.199323
H 0.459082 2.343751 0.113744
H -3.820276 3.516347 -0.077058
H -4.696116 2.556587 -1.289668
H -6.221226 1.661923 0.522436
H -5.348172 2.622745 1.732564
H -6.914952 3.797906 -0.681725
H -6.036971 4.764907 0.536284
H -7.466056 3.807258 1.018014
H -0.595142 -3.224608 -2.344689
H -1.718302 -1.754057 1.580864
H -0.604541 0.355516 1.268482
H 2.436278 -0.300500 1.715877
H 2.465818 2.717422 -1.394760
H 0.367695 -5.288989 -1.300350
H -0.755231 -3.814502 2.631372
H 4.951316 -0.529506 1.514024
H 4.954036 2.495676 -1.606789
H 0.289625 -5.591935 1.193002


