%chk=000189375.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000189375

0 1
Cl -2.017928 -4.608414 1.478434
N -3.248948 -0.183795 -0.418794
N 1.329261 -1.448507 -0.505436
N -0.918199 -0.761953 -0.517089
N -2.606445 -2.262950 0.453014
N -0.270835 -2.940400 0.446109
C -3.100400 1.170110 -1.059702
C -2.183189 2.058756 -0.212746
C 4.310271 -0.699751 0.176078
C 3.771346 -1.851669 -0.681554
C 5.643257 -0.172161 -0.370218
C -2.600095 0.972010 -2.496615
C -4.504695 1.806065 -1.069964
C 2.431625 -2.390212 -0.171564
C 6.185923 0.977269 0.490887
C -1.310740 2.974983 -0.815398
C -2.249874 2.000663 1.188905
C -2.220035 -1.060341 -0.173048
C 7.512374 1.507769 -0.047901
C 0.029187 -1.724568 -0.180607
C -0.513091 3.814049 -0.030352
C -1.450065 2.837208 1.970990
C -0.579346 3.747558 1.363591
C -1.592956 -3.124235 0.716270
H 3.570665 0.122852 0.223259
H 4.439909 -1.040195 1.222664
H 3.686546 -1.535489 -1.740725
H 4.504301 -2.685466 -0.688364
H 5.517000 0.170958 -1.415085
H 6.387124 -0.991217 -0.411563
H -3.202390 0.231795 -3.035899
H -2.631707 1.902657 -3.071162
H -1.560925 0.604797 -2.506752
H -4.460010 2.818499 -1.492969
H -5.215211 1.235756 -1.678421
H -4.922985 1.908518 -0.061252
H -4.191461 -0.491166 -0.162036
H 2.205847 -3.385276 -0.626770
H 2.453510 -2.558788 0.931834
H 6.317640 0.635195 1.536360
H 5.444512 1.799230 0.533670
H -1.239128 3.041829 -1.899641
H -2.920407 1.295276 1.678849
H 1.557629 -0.549879 -0.926537
H 8.282346 0.727979 -0.066596
H 7.410142 1.891530 -1.069323
H 7.892134 2.327161 0.573054
H 0.162345 4.520023 -0.509880
H -1.504901 2.777863 3.056727
H 0.042770 4.398970 1.973368


%chk=000189375-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000189375

0 1
Cl -2.208064 -4.781047 1.217953
N -3.187564 -0.184757 -0.540842
N 1.323993 -1.495386 -0.266939
N -0.893299 -0.782889 -0.458474
N -2.664836 -2.303714 0.267904
N -0.348082 -3.002387 0.425721
C -3.008836 1.181710 -1.107826
C -2.164979 2.062355 -0.152486
C 4.271703 -0.618379 0.110165
C 3.757804 -1.950392 -0.486848
C 5.674031 -0.228892 -0.411077
C -2.408841 1.076594 -2.534585
C -4.438254 1.791361 -1.194752
C 2.409117 -2.428708 0.085970
C 6.192832 1.104059 0.174356
C -1.289588 3.065147 -0.636872
C -2.329745 1.934349 1.250766
C -2.203684 -1.088755 -0.249393
C 7.596590 1.482291 -0.345932
C -0.000244 -1.765154 -0.094800
C -0.595265 3.914365 0.255449
C -1.636804 2.777518 2.144845
C -0.765431 3.776144 1.650882
C -1.679016 -3.164754 0.554911
H 3.568756 0.210943 -0.118320
H 4.298442 -0.702172 1.216265
H 3.682008 -1.864894 -1.589975
H 4.505228 -2.742326 -0.284406
H 5.649753 -0.157532 -1.518731
H 6.392339 -1.039601 -0.167939
H -3.028275 0.392127 -3.140596
H -2.404189 2.059543 -3.037220
H -1.380907 0.682624 -2.492769
H -4.381989 2.819074 -1.589500
H -5.078202 1.194083 -1.871753
H -4.910868 1.838490 -0.196901
H -4.136089 -0.529488 -0.376640
H 2.147302 -3.428515 -0.303420
H 2.474953 -2.526914 1.188777
H 6.213254 1.032317 1.280874
H 5.475575 1.913850 -0.071038
H -1.131977 3.186927 -1.713156
H -2.991477 1.154513 1.645668
H 1.546853 -0.554853 -0.596940
H 8.338890 0.704148 -0.085805
H 7.595727 1.589057 -1.447247
H 7.944786 2.438520 0.085755
H 0.078887 4.682527 -0.141057
H -1.774034 2.654649 3.225247
H -0.226585 4.433119 2.342832


