%chk=000266496.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000266496

0 1
Cl 5.338729 0.570641 -0.089156
N 0.239281 1.058765 -0.230326
N -5.280029 -0.150539 0.090104
N 1.195245 -1.103426 0.182335
N 2.792553 2.239683 -0.407363
N 3.602588 -1.386672 0.263229
C -1.142192 0.674428 -0.112319
C -2.974465 -0.892008 -0.423653
C -1.615342 -0.584965 -0.515111
C -3.876702 0.085895 0.075989
C -2.033337 1.644539 0.381356
C -3.390331 1.347655 0.472245
C 1.341161 0.251835 -0.065890
C -3.461274 -2.235859 -0.859717
C 2.666970 0.824537 -0.158897
C 3.739069 -0.058760 0.014500
C 2.316720 -1.849422 0.336619
H -0.917515 -1.336011 -0.895487
H -1.675221 2.622662 0.697931
H 0.423095 2.063951 -0.366612
H -4.078667 2.103672 0.845920
H -3.899698 -2.799696 -0.025253
H -4.221733 -2.147079 -1.650519
H -2.652774 -2.858812 -1.268413
H -5.552718 -1.120250 0.180845
H -5.801562 0.429610 0.734430
H 3.274170 2.399203 -1.294048
H 3.354485 2.677749 0.324653
H 2.183093 -2.926125 0.539205


%chk=000266496-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000266496

0 1
Cl 5.494123 0.707747 0.016944
N 0.297406 0.946765 0.063483
N -5.290343 -0.064447 -0.078345
N 1.325472 -1.220937 -0.118394
N 2.781625 2.217056 -0.076577
N 3.743803 -1.396350 -0.072677
C -1.092883 0.623768 0.031206
C -2.992066 -0.920057 -0.266598
C -1.603313 -0.675568 -0.223922
C -3.908819 0.157155 -0.043010
C -2.006983 1.686790 0.254233
C -3.392507 1.456497 0.218989
C 1.417970 0.144114 -0.050548
C -3.518265 -2.317442 -0.538970
C 2.707344 0.813424 -0.081778
C 3.813690 -0.053819 -0.053172
C 2.490427 -1.923481 -0.139659
H -0.895941 -1.493460 -0.373744
H -1.636097 2.700633 0.456258
H 0.507313 1.908994 0.346345
H -4.084000 2.289446 0.395282
H -4.140074 -2.693920 0.299153
H -4.141923 -2.352210 -1.455888
H -2.689627 -3.030423 -0.678303
H -5.667951 -0.989016 -0.256761
H -5.940649 0.697659 0.086738
H 2.186001 2.725875 -0.734272
H 3.715470 2.612048 0.054950
H 2.414394 -3.011641 -0.204367


