%chk=000188204.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000188204

0 1
Cl 2.196685 -1.820646 -1.858244
O 6.477398 1.514176 -0.303389
O -2.973135 1.974744 0.767114
N 0.488457 -0.915765 0.451026
N -0.869811 -0.893232 0.563518
N -3.605759 -0.095366 -0.048838
N -0.048545 3.723891 -0.468552
C 1.015056 0.355196 0.150939
C 2.431378 0.654497 -0.000300
C -0.103175 1.210793 0.063571
C -1.254869 0.391983 0.329219
C 1.204756 -2.153621 0.641650
C 3.365213 0.226452 0.968014
C 2.865181 1.407577 -1.104575
C -2.675210 0.860587 0.389609
C 2.039862 -2.657997 -0.372520
C 1.049561 -2.865908 1.842553
C 4.709991 0.533320 0.830314
C 4.213902 1.727307 -1.261717
C 5.125345 1.286535 -0.291700
C 2.743748 -3.849339 -0.179172
C 1.749447 -4.060224 2.025605
C -0.083002 2.593902 -0.222430
C 2.596246 -4.547113 1.023028
C -5.026328 0.087369 -0.108170
C -5.646447 1.306938 0.211024
C -5.798063 -1.021401 -0.517510
C -7.035453 1.410310 0.117522
C -7.184243 -0.893691 -0.603600
C -7.808406 0.317930 -0.287881
C 7.026199 2.312039 -1.382818
H 3.025441 -0.343686 1.834366
H 2.140668 1.746414 -1.849436
H 0.377649 -2.488095 2.617921
H 5.449048 0.217464 1.564223
H 4.533925 2.311908 -2.118841
H -3.264314 -1.028983 -0.305383
H 3.397322 -4.230661 -0.966422
H 1.632025 -4.616401 2.957099
H 3.142238 -5.479415 1.176798
H -5.050940 2.169030 0.530514
H -5.326213 -1.968566 -0.764937
H -7.517947 2.356448 0.364523
H -7.783782 -1.746890 -0.919649
H -8.889347 0.409350 -0.357591
H 8.092640 2.336051 -1.120775
H 6.868714 1.811812 -2.342412
H 6.596892 3.318275 -1.367788


%chk=000188204-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000188204

0 1
Cl 1.923428 -1.957044 -2.291260
O 6.663198 1.461056 -0.014367
O -2.951129 2.240833 -0.394641
N 0.454441 -0.787686 0.198636
N -0.941285 -0.728310 0.206996
N -3.561220 -0.002927 0.056667
N 0.205892 3.912725 -0.735657
C 1.045346 0.452120 -0.063779
C 2.492786 0.704255 -0.073039
C -0.041867 1.350555 -0.250355
C -1.234623 0.573581 -0.069963
C 1.072748 -2.071551 0.385702
C 3.372321 0.065407 0.850202
C 3.044105 1.632244 -0.994898
C -2.656355 1.031351 -0.154416
C 1.782249 -2.720725 -0.652629
C 0.911070 -2.730367 1.627257
C 4.747414 0.338283 0.842079
C 4.423427 1.914867 -1.013111
C 5.282611 1.263305 -0.092030
C 2.365602 -3.986246 -0.446591
C 1.477878 -4.003931 1.838001
C 0.064484 2.746168 -0.510653
C 2.214286 -4.626644 0.803414
C -4.979867 0.045674 0.056512
C -5.713637 1.241523 -0.173709
C -5.673864 -1.171719 0.300323
C -7.124194 1.198805 -0.155548
C -7.082386 -1.195603 0.314689
C -7.818501 -0.008848 0.086758
C 7.269132 2.428120 -0.937902
H 2.976627 -0.629744 1.596958
H 2.392304 2.132676 -1.717330
H 0.336425 -2.228539 2.411803
H 5.426106 -0.140255 1.553939
H 4.810606 2.633795 -1.740143
H -3.126494 -0.917690 0.230706
H 2.915817 -4.466505 -1.260611
H 1.348514 -4.504843 2.802326
H 2.663895 -5.612368 0.960319
H -5.176120 2.172841 -0.361507
H -5.108354 -2.095948 0.476436
H -7.684075 2.123742 -0.333835
H -7.604512 -2.140252 0.503146
H -8.913466 -0.026788 0.097648
H 8.339504 2.429426 -0.686996
H 7.131740 2.115860 -1.990872
H 6.847988 3.440619 -0.789172


