%chk=000207017.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000207017

0 1
Cl -2.106701 1.171151 3.984896
Cl -4.812854 -0.531933 -3.039637
N -2.328045 0.280578 0.049958
N -1.194257 0.804266 -0.637189
N 2.736986 -0.690285 0.127290
C 0.084910 0.262121 -0.298999
C 1.190369 1.164240 -0.305783
C 0.316850 -1.120650 -0.077689
C -2.605469 0.991808 1.352618
C -3.524606 0.375934 -0.864672
C 2.507349 0.629920 -0.101685
C 1.677300 -1.545085 0.142024
C 1.072725 2.586858 -0.504023
C -0.697553 -2.143561 -0.078863
C 3.653700 1.517232 -0.121304
C 1.966431 -2.941527 0.392096
C -1.632774 0.466926 2.407304
C -3.297474 -0.518589 -2.083112
C 2.168003 3.398546 -0.511250
C -0.392253 -3.453261 0.151852
C 3.484016 2.852162 -0.320968
C 0.961908 -3.859754 0.399336
H -1.186713 1.841977 -0.717061
H -3.650638 0.758837 1.666046
H -2.546252 2.099663 1.281523
H -3.756550 1.414770 -1.188048
H -4.408312 0.011746 -0.288502
H 0.077787 3.011689 -0.653123
H -1.733138 -1.855317 -0.275934
H 4.636974 1.066229 0.028678
H 3.009389 -3.212555 0.567014
H -1.671244 -0.638000 2.493318
H -0.582889 0.757210 2.210665
H -2.482046 -0.147595 -2.735153
H -3.058570 -1.561636 -1.795656
H 2.074087 4.472831 -0.660735
H -1.166233 -4.218520 0.148779
H 4.334032 3.534436 -0.339978
H 1.161055 -4.915060 0.586171


%chk=000207017-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000207017

0 1
Cl -3.044478 0.917377 4.292132
Cl -3.887654 0.055062 -3.626704
N -2.411130 0.306384 0.240006
N -1.144712 0.928825 0.041158
N 2.809668 -0.745128 -0.228827
C 0.103861 0.307236 -0.062191
C 1.227556 1.178202 -0.341559
C 0.347701 -1.104410 0.098808
C -3.035542 0.770318 1.517469
C -3.297755 0.505933 -0.948753
C 2.558199 0.590303 -0.399364
C 1.735678 -1.562514 0.001643
C 1.109737 2.595966 -0.567247
C -0.667516 -2.098743 0.352151
C 3.691457 1.441601 -0.651880
C 2.023567 -2.964987 0.162224
C -2.244728 0.247916 2.721403
C -2.765962 -0.283184 -2.149423
C 2.227850 3.391076 -0.814930
C -0.346521 -3.446167 0.499774
C 3.537679 2.808848 -0.852304
C 1.014671 -3.889088 0.405083
H -1.166752 1.952619 -0.044060
H -4.065444 0.374375 1.551899
H -3.099033 1.883200 1.565178
H -3.389543 1.584313 -1.218314
H -4.304616 0.139115 -0.682928
H 0.133887 3.097660 -0.569288
H -1.705727 -1.771453 0.421617
H 4.670925 0.954681 -0.680699
H 3.074898 -3.257261 0.081417
H -2.276702 -0.847164 2.800965
H -1.206177 0.606837 2.734545
H -1.760168 0.036413 -2.455490
H -2.793096 -1.368522 -1.982119
H 2.105166 4.465679 -0.987944
H -1.142458 -4.175138 0.688832
H 4.409316 3.443483 -1.045214
H 1.253199 -4.951860 0.523140


