%chk=000180790.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000180790

0 1
Cl 7.342820 -0.446834 0.473470
O 1.106942 0.823191 -1.699071
O -5.686204 -0.110911 1.473661
N 0.656998 -0.293819 0.273359
N -5.741609 -0.465581 -0.764232
N -7.157929 -0.531317 -0.821416
C -0.769687 -0.257156 0.260197
C -3.566176 -0.255100 0.340678
C -1.498717 0.415471 -0.737719
C -1.444359 -0.922848 1.309010
C 2.967287 0.074116 -0.379932
C -2.890912 0.415048 -0.689102
C -2.835172 -0.910511 1.345495
C 1.516200 0.265065 -0.704502
C 3.526328 0.666690 0.760680
C 3.763073 -0.664961 -1.266759
C -5.050824 -0.261846 0.440688
C 4.887885 0.508968 1.029234
C 5.124757 -0.832553 -1.003706
C 5.664868 -0.242918 0.142707
H -0.978220 0.939959 -1.547799
H -0.891226 -1.438962 2.090371
H 1.083451 -0.790912 1.061440
H -3.451369 0.954195 -1.455914
H -3.368230 -1.406648 2.161886
H 2.905840 1.261146 1.433848
H 3.320757 -1.102160 -2.165249
H 5.338036 0.967386 1.910674
H 5.755732 -1.406832 -1.683583
H -5.300118 -0.725337 -1.645563
H -7.506029 -1.185943 -0.104114
H -7.547392 0.387010 -0.560335


%chk=000180790-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000180790

0 1
Cl 7.538753 -0.196790 0.525470
O 1.180587 0.178938 -1.975294
O -5.712618 -0.223631 1.584632
N 0.640126 -0.284108 0.263083
N -5.851597 -0.345137 -0.727339
N -7.272571 -0.371766 -0.740915
C -0.779182 -0.262156 0.229419
C -3.625957 -0.256820 0.326344
C -1.528338 0.079512 -0.929309
C -1.464255 -0.587669 1.434226
C 2.997642 -0.077024 -0.390690
C -2.935487 0.081049 -0.866634
C -2.866169 -0.580373 1.480139
C 1.541545 -0.041544 -0.778822
C 3.472838 0.146315 0.929110
C 3.936135 -0.308207 -1.429693
C -5.122373 -0.266619 0.458861
C 4.854738 0.112525 1.213575
C 5.318412 -0.350496 -1.161185
C 5.757078 -0.145342 0.162838
H -1.002668 0.337496 -1.849590
H -0.892802 -0.843985 2.335933
H 1.045818 -0.556680 1.160944
H -3.485541 0.388665 -1.763640
H -3.404221 -0.815571 2.403857
H 2.787156 0.396333 1.747654
H 3.558551 -0.446456 -2.447602
H 5.222976 0.294770 2.226927
H 6.039873 -0.536205 -1.961732
H -5.408274 -0.538194 -1.625100
H -7.616648 -1.101574 -0.098609
H -7.646727 0.545838 -0.458454


