%chk=000245085.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000245085

0 1
Cl 7.489537 0.634129 -0.938603
N -5.530664 -0.153118 0.590828
N 1.898581 -0.856752 0.308483
C -1.773965 0.180561 -0.088154
C -3.083837 -0.405713 0.451667
C -0.564169 -0.623085 0.405743
C -4.296659 0.399889 -0.044830
C -6.765284 0.629492 0.279025
C 0.744007 -0.024406 -0.132302
C -7.168719 0.584908 -1.205748
C -7.897134 0.081008 1.159666
C 3.212489 -0.420484 0.034969
C 3.499699 0.482759 -1.013895
C 4.276353 -0.987224 0.783844
C 4.822650 0.803003 -1.313914
C 5.593838 -0.664693 0.477235
C 5.853022 0.229456 -0.566624
H -1.678932 1.238893 0.225579
H -1.793499 0.191532 -1.195672
H -3.180361 -1.466552 0.151480
H -3.077279 -0.409856 1.561194
H -0.554674 -0.644101 1.513193
H -0.654796 -1.680711 0.083109
H -4.334587 0.390249 -1.155488
H -4.195227 1.464251 0.262826
H -6.566885 1.695883 0.566824
H 0.730066 -0.018404 -1.247324
H 0.851513 1.033397 0.198150
H -5.652788 -1.134769 0.324595
H -7.345060 -0.438461 -1.551496
H -8.094053 1.145080 -1.377913
H -6.399904 1.023971 -1.848540
H -7.587496 0.048252 2.213121
H -8.187211 -0.935914 0.876897
H -8.788954 0.711462 1.093153
H 1.764823 -1.293910 1.220553
H 2.699350 0.921975 -1.602295
H 4.067186 -1.684789 1.590732
H 5.050490 1.495770 -2.124884
H 6.416636 -1.100979 1.044817


%chk=000245085-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000245085

0 1
Cl 7.703468 0.387191 -1.093574
N -5.581199 -0.145901 0.547481
N 1.934181 -0.621596 0.456233
C -1.783167 0.240456 -0.090972
C -3.100736 -0.290045 0.516048
C -0.534997 -0.460084 0.488920
C -4.351847 0.405686 -0.058707
C -6.855371 0.563617 0.261218
C 0.777878 0.069516 -0.120144
C -7.269016 0.566381 -1.238252
C -7.967890 -0.045330 1.139154
C 3.255767 -0.375209 0.090509
C 3.590820 0.595443 -0.901855
C 4.317722 -1.103051 0.711227
C 4.937230 0.825143 -1.258491
C 5.660000 -0.873812 0.356001
C 5.957400 0.090312 -0.628825
H -1.709847 1.332820 0.090381
H -1.801835 0.105720 -1.192429
H -3.173993 -1.383230 0.331555
H -3.100372 -0.155599 1.614899
H -0.512834 -0.317910 1.589074
H -0.607782 -1.551982 0.305171
H -4.324148 0.330553 -1.175668
H -4.313619 1.487210 0.183889
H -6.701546 1.616669 0.576401
H 0.755176 -0.074247 -1.222713
H 0.851451 1.165040 0.058941
H -5.670448 -1.158316 0.373642
H -7.470473 -0.465439 -1.586956
H -8.187239 1.163408 -1.393774
H -6.475106 0.996361 -1.876049
H -7.684179 0.002402 2.204491
H -8.136959 -1.108295 0.875164
H -8.923815 0.490821 0.998528
H 1.756342 -1.315898 1.181021
H 2.805786 1.174090 -1.396990
H 4.086397 -1.853989 1.476924
H 5.183467 1.571327 -2.020098
H 6.463433 -1.438235 0.838622


