%chk=000291946.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000291946

0 1
Cl 5.221536 1.451531 0.215481
N -3.043990 1.233352 -1.398748
N -2.755490 1.764170 0.946372
N -1.636822 -0.287619 -2.508526
N -1.221658 0.611540 2.303345
C -0.260536 -0.950055 -0.001692
C -1.338647 0.048014 -0.089416
C 1.102509 -0.370635 0.048163
C -0.506006 -2.279534 0.019215
C -2.012684 0.312052 -1.311960
C -1.748808 0.812742 1.035541
C 1.959822 -0.658787 1.123883
C 1.533962 0.496374 -0.971730
C -1.893275 -2.839820 0.009774
C 0.579268 -3.309041 0.044293
C 3.237482 -0.096328 1.181993
C 2.809094 1.061847 -0.926162
C 3.642515 0.755056 0.152693
C -3.354366 1.915819 -0.263241
H 1.631926 -1.331305 1.915385
H 0.863216 0.733237 -1.800153
H -2.152205 -3.256952 -0.971919
H -2.003126 -3.650002 0.744530
H -2.656968 -2.086832 0.258003
H 1.544771 -2.925301 -0.315353
H 0.331045 -4.179018 -0.578807
H 0.740371 -3.683976 1.065384
H 3.905477 -0.317940 2.013579
H 3.148067 1.733201 -1.715240
H -2.242352 -0.173268 -3.310669
H -1.097983 -1.138899 -2.476197
H -1.447066 1.283282 3.025799
H -0.327247 0.154129 2.389772
H -4.165334 2.660466 -0.332793


%chk=000291946-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000291946

0 1
Cl 5.347980 1.565967 0.410687
N -3.145966 1.102862 -1.472790
N -2.683326 1.916619 0.776902
N -1.917895 -0.629847 -2.434242
N -1.021615 0.974580 2.110743
C -0.254742 -0.962860 0.004576
C -1.364423 0.037955 -0.134730
C 1.126173 -0.380817 0.100306
C -0.513564 -2.320971 0.022875
C -2.138426 0.167616 -1.329880
C -1.682407 0.971261 0.901978
C 2.100365 -0.876550 1.013737
C 1.477034 0.747724 -0.693888
C -1.929883 -2.867480 0.049544
C 0.556088 -3.401261 -0.020640
C 3.382587 -0.293660 1.114540
C 2.754814 1.338957 -0.612267
C 3.694045 0.804732 0.291498
C -3.353242 1.915607 -0.404029
H 1.849989 -1.714664 1.672850
H 0.737767 1.167362 -1.384443
H -2.199516 -3.338716 -0.917251
H -2.013677 -3.660501 0.818280
H -2.676968 -2.087778 0.265776
H 1.540132 -3.022299 -0.339639
H 0.247032 -4.202060 -0.720488
H 0.680885 -3.888245 0.967509
H 4.118633 -0.680445 1.825420
H 3.012868 2.200317 -1.235086
H -2.491410 -0.465760 -3.258357
H -1.189903 -1.339076 -2.432537
H -1.286925 1.686280 2.788230
H -0.223719 0.369379 2.283652
H -4.152288 2.657272 -0.508238


