%chk=000217760.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000217760

0 1
Cl 3.230128 -2.443400 1.578326
O 1.261074 0.585243 -1.382087
N -2.739845 0.634080 0.062365
N 2.089028 0.151441 0.719507
C -5.212651 0.022034 -0.288026
C -3.748063 -0.046662 -0.820930
C -5.366216 -1.215941 0.618780
C -3.422406 -1.567499 -0.860689
C -5.601031 1.335631 0.396353
C -4.501629 -2.302299 -0.041901
C -4.496090 1.835903 1.327816
C -3.183966 1.979499 0.546739
C -1.406098 0.741679 -0.613793
C -0.324757 0.428946 0.439501
C 1.045373 0.394607 -0.200196
C 3.459598 -0.041727 0.336853
C 4.194916 0.943195 -0.366645
C 4.108617 -1.236011 0.709678
C 5.540022 0.684842 -0.680588
C 3.573430 2.232289 -0.777326
C 5.445990 -1.478329 0.405927
C 6.159861 -0.506535 -0.301479
H -5.882240 -0.112776 -1.174216
H -3.724738 0.381029 -1.853035
H -6.416575 -1.523991 0.721110
H -4.993591 -0.994581 1.635534
H -2.422138 -1.772134 -0.439177
H -3.401732 -1.927235 -1.901310
H -6.543206 1.199903 0.960842
H -5.818664 2.102964 -0.372009
H -4.046493 -2.962151 0.714577
H -5.112788 -2.949214 -0.693660
H -4.775328 2.803094 1.782378
H -4.354294 1.122485 2.165088
H -3.308824 2.715752 -0.277088
H -2.390090 2.375221 1.217059
H -1.215301 1.738962 -1.065642
H -1.314495 0.016068 -1.452947
H -0.564731 -0.543417 0.923777
H -0.366353 1.175081 1.258493
H 1.864040 -0.127440 1.676932
H 6.109947 1.433277 -1.231759
H 3.018751 2.702451 0.046331
H 4.301425 2.963391 -1.146741
H 2.839348 2.056821 -1.591791
H 5.921527 -2.410736 0.707925
H 7.204457 -0.682308 -0.556757


%chk=000217760-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000217760

0 1
Cl 3.670142 -1.070108 2.972154
O 1.204626 -0.552134 -1.186179
N -2.750520 0.453630 0.205029
N 2.143702 0.329917 0.775048
C -5.232460 0.251280 -0.243593
C -3.796792 0.268893 -0.856245
C -5.379741 -1.203717 0.267877
C -3.677780 -1.137337 -1.530301
C -5.511915 1.369067 0.783142
C -4.786318 -2.043401 -0.892348
C -4.371036 1.482914 1.814867
C -3.026399 1.623209 1.082653
C -1.379960 0.537378 -0.361308
C -0.304800 0.074588 0.648862
C 1.064717 -0.078489 -0.021910
C 3.529637 0.181978 0.460875
C 4.102526 0.707213 -0.738929
C 4.386990 -0.450613 1.399511
C 5.489844 0.514153 -0.960752
C 3.276832 1.494367 -1.733334
C 5.763156 -0.620787 1.187342
C 6.313697 -0.142653 -0.022818
H -5.934575 0.373290 -1.096193
H -3.715257 1.088573 -1.614960
H -6.429206 -1.465834 0.495920
H -4.780701 -1.342499 1.185868
H -2.676780 -1.568248 -1.362036
H -3.813479 -1.053156 -2.624297
H -6.480939 1.184146 1.286479
H -5.608734 2.339030 0.252579
H -4.380669 -3.010446 -0.546509
H -5.574080 -2.267410 -1.636523
H -4.529981 2.360598 2.470725
H -4.338854 0.586445 2.461784
H -3.030902 2.578095 0.489169
H -2.205831 1.706830 1.818997
H -1.143110 1.573964 -0.711971
H -1.296062 -0.116784 -1.243839
H -0.616887 -0.916828 1.031174
H -0.245717 0.756911 1.517562
H 1.929211 0.510562 1.760495
H 5.929807 0.908788 -1.883287
H 2.597694 2.198554 -1.218068
H 3.929088 2.069105 -2.412242
H 2.637005 0.818804 -2.328262
H 6.381012 -1.119064 1.938980
H 7.382997 -0.271274 -0.219089


