%chk=000245589.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000245589

0 1
Cl -3.186593 3.940450 -0.576904
Cl -5.581904 -2.570866 0.641278
O -1.024039 -1.569019 -0.450082
O 5.283170 -0.619036 -0.213095
N -2.539056 0.023607 0.195762
N -0.178038 0.509196 0.161439
C -2.897742 1.445140 0.379399
C -3.640552 -0.903802 -0.184900
C -1.211113 -0.423883 -0.067882
C -2.854274 2.224043 -0.940595
C -4.118927 -1.634013 1.073354
C 1.223518 0.196207 0.087120
C 2.121644 1.162470 0.571836
C 1.703701 -1.006837 -0.475296
C 3.961474 -0.252849 -0.065932
C 3.500365 0.942029 0.494694
C 3.069127 -1.233403 -0.552293
C 6.293992 0.305331 0.253483
H -3.918259 1.507825 0.828969
H -2.217237 1.909136 1.132436
H -4.473674 -0.346749 -0.666016
H -3.274671 -1.649682 -0.937379
H -1.867996 2.161803 -1.440368
H -3.616532 1.870332 -1.660667
H -3.354016 -2.342605 1.449295
H -4.385226 -0.942990 1.893076
H -0.402518 1.415664 0.576243
H 1.760964 2.091501 1.009538
H 1.000907 -1.764332 -0.846131
H 4.185039 1.696042 0.869541
H 3.467277 -2.152970 -0.980028
H 7.218811 -0.236358 0.013898
H 6.200455 0.460090 1.331997
H 6.236923 1.245329 -0.302389


%chk=000245589-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000245589

0 1
Cl -3.094596 4.165394 -0.229404
Cl -5.618558 -2.701821 0.576230
O -1.134967 -1.722169 -0.436454
O 5.359865 -0.653595 -0.070787
N -2.570367 0.055769 0.031399
N -0.214651 0.373738 0.123913
C -2.847571 1.448322 0.422793
C -3.714537 -0.835932 -0.268460
C -1.277130 -0.502046 -0.112969
C -2.803866 2.387906 -0.799555
C -4.066260 -1.694601 0.957406
C 1.183672 0.079349 0.068851
C 2.079444 1.138183 0.359409
C 1.709190 -1.200552 -0.261618
C 3.992918 -0.333570 -0.003849
C 3.476725 0.943334 0.325947
C 3.100689 -1.394572 -0.294612
C 6.314970 0.415929 0.221559
H -3.850540 1.499318 0.880849
H -2.146113 1.799438 1.203862
H -4.581718 -0.218808 -0.562873
H -3.449871 -1.497494 -1.109072
H -1.826515 2.387705 -1.304964
H -3.603735 2.164121 -1.520388
H -3.273460 -2.422739 1.176201
H -4.312886 -1.090344 1.843786
H -0.429193 1.338476 0.377422
H 1.688679 2.132050 0.616343
H 1.023897 -2.018455 -0.488174
H 4.138295 1.783574 0.555602
H 3.519022 -2.373601 -0.547504
H 7.307231 -0.045246 0.110003
H 6.194506 0.793798 1.256122
H 6.212430 1.255941 -0.493613


