%chk=000201738.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000201738

0 1
Cl -3.989521 -1.706819 3.479815
O -0.967394 1.494654 -0.404489
O 1.692399 3.385423 1.119044
O -2.443945 -0.354977 -1.253363
N 3.299516 -0.929941 -0.735185
N 1.600665 1.194315 0.461520
C 3.844181 0.372470 -0.235068
C 3.451103 -1.068517 -2.220875
C 3.908632 -2.090041 -0.002611
C 2.964254 0.861864 0.935382
C 2.437646 -0.171619 -2.933191
C 3.006717 -3.318242 -0.132968
C 1.097969 2.472598 0.560180
C -0.282820 2.715184 -0.055709
C -1.634488 0.823527 0.606194
C -2.468975 -0.234004 0.112487
C -1.542096 1.071295 1.968323
C -3.195384 -1.016854 1.002914
C -2.280298 0.280724 2.870344
C -3.082968 -0.735160 2.375356
C -3.267000 -1.394991 -1.841139
H 3.826675 1.133034 -1.047749
H 4.901049 0.310877 0.100196
H 4.480456 -0.841181 -2.572272
H 3.250718 -2.130087 -2.492417
H 4.935564 -2.329325 -0.354098
H 3.996501 -1.819384 1.073485
H 3.426121 1.759284 1.412816
H 2.878296 0.074467 1.718711
H 2.452872 -0.342683 -4.014287
H 2.633769 0.892531 -2.758838
H 1.417360 -0.369899 -2.576140
H 3.350279 -4.129437 0.516806
H 2.975596 -3.698783 -1.160200
H 1.972382 -3.075389 0.147800
H 1.125461 0.465533 -0.079897
H -0.181549 3.201252 -1.049393
H -0.900763 3.356111 0.598357
H -0.901065 1.862401 2.357164
H -3.838296 -1.825352 0.664366
H -2.211284 0.473225 3.940412
H -3.059105 -1.257035 -2.910867
H -4.323259 -1.215865 -1.621040
H -2.936971 -2.380484 -1.500775


%chk=000201738-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000201738

0 1
Cl -3.272840 -2.510899 3.122988
O -0.748589 1.695572 -0.395221
O 1.754926 3.628453 1.505295
O -1.782336 -0.468175 -1.502893
N 2.880175 -0.799709 -0.657809
N 1.888632 1.587770 0.366005
C 3.832565 0.294090 -0.320929
C 2.944921 -1.221831 -2.086279
C 2.949154 -1.938158 0.303182
C 3.247317 1.219978 0.771034
C 2.212695 -0.247055 -3.028853
C 1.641307 -2.748610 0.377234
C 1.251919 2.729843 0.758025
C -0.161680 2.921701 0.167196
C -1.302779 0.763242 0.498199
C -1.875738 -0.400115 -0.110404
C -1.325583 0.898473 1.901986
C -2.475890 -1.390432 0.699180
C -1.925559 -0.093321 2.717659
C -2.491279 -1.214906 2.098258
C -2.380093 -1.634937 -2.159265
H 4.002970 0.894290 -1.232255
H 4.823242 -0.094254 0.012752
H 4.003576 -1.355798 -2.419339
H 2.465413 -2.213996 -2.163418
H 3.805258 -2.615264 0.059344
H 3.157650 -1.518430 1.305001
H 3.856137 2.133905 0.889148
H 3.234673 0.709568 1.755993
H 2.273746 -0.603768 -4.074260
H 2.653163 0.766363 -2.997719
H 1.148729 -0.163195 -2.743275
H 1.736580 -3.561224 1.121113
H 1.387651 -3.213376 -0.593116
H 0.800928 -2.097464 0.674875
H 1.414370 0.879291 -0.213423
H -0.095364 3.610992 -0.691159
H -0.812850 3.378907 0.934088
H -0.867128 1.765714 2.385139
H -2.926063 -2.282967 0.259525
H -1.940256 0.017584 3.804653
H -2.203925 -1.476960 -3.232948
H -3.468264 -1.691780 -1.963140
H -1.892479 -2.574413 -1.833067


