%chk=000296315.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000296315

0 1
Cl 4.356526 1.996292 0.269908
O 4.527523 -2.385357 0.793059
N -3.663530 -0.117033 -0.013574
N -0.362965 1.078905 -1.434688
C -2.333893 0.566235 0.048629
C -1.673222 0.395135 -1.339693
C -4.706036 0.608659 0.784873
C -3.550488 -1.554692 0.407606
C -5.112756 1.898038 0.070210
C -4.737190 -2.349776 -0.138244
C 0.764764 0.573464 -0.763060
C 1.868027 1.437090 -0.553227
C 0.862807 -0.783764 -0.369818
C 3.151731 -0.424754 0.390632
C 3.025384 0.914621 0.011381
C 2.038372 -1.261491 0.195315
C 4.407444 -0.970206 1.010715
H -1.667642 0.174041 0.846066
H -2.464619 1.647846 0.267103
H -2.338772 0.813184 -2.130354
H -1.554157 -0.683579 -1.587137
H -5.596849 -0.055443 0.868947
H -4.377380 0.830606 1.822904
H -2.609642 -1.973003 -0.014575
H -3.482117 -1.675840 1.510477
H -0.431850 2.095109 -1.486883
H -4.308561 2.641582 0.068486
H -5.368056 1.698170 -0.979714
H -5.987693 2.351556 0.547354
H -5.679879 -2.064711 0.342706
H -4.864509 -2.173967 -1.215445
H -4.593961 -3.424448 0.013499
H 1.819678 2.485098 -0.837917
H 0.022627 -1.457164 -0.520711
H 2.114730 -2.309737 0.502026
H 5.323450 -0.479430 0.630937
H 4.378367 -0.895511 2.117539
H 4.603938 -2.573024 -0.165034


%chk=000296315-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000296315

0 1
Cl 4.737870 1.848020 -0.277444
O 4.559566 -2.558735 0.820460
N -3.729105 -0.073895 0.028411
N -0.344009 1.218195 -1.182904
C -2.448863 0.669736 0.111290
C -1.656973 0.566054 -1.221589
C -4.839630 0.569711 0.781303
C -3.569414 -1.520427 0.345907
C -5.397912 1.818438 0.072790
C -4.644838 -2.407029 -0.310407
C 0.816129 0.653754 -0.653512
C 2.038073 1.391052 -0.697853
C 0.843761 -0.652207 -0.075796
C 3.274132 -0.469385 0.387106
C 3.211832 0.821366 -0.185580
C 2.046843 -1.183503 0.422434
C 4.543691 -1.090874 0.952150
H -1.807195 0.316975 0.954247
H -2.659752 1.736715 0.305810
H -2.263633 1.030751 -2.018846
H -1.536138 -0.497353 -1.505175
H -5.654061 -0.171104 0.876027
H -4.528513 0.831816 1.824234
H -2.578186 -1.840714 -0.028122
H -3.556568 -1.693983 1.451957
H -0.277501 2.167661 -1.546743
H -4.631748 2.607520 -0.039750
H -5.762280 1.551475 -0.934435
H -6.236090 2.249080 0.651878
H -5.660916 -2.153823 0.042168
H -4.624842 -2.279946 -1.406715
H -4.465194 -3.471934 -0.071754
H 2.063584 2.395036 -1.134729
H -0.070698 -1.248959 -0.011528
H 2.060910 -2.185639 0.865476
H 5.436169 -0.635476 0.479390
H 4.620406 -0.929142 2.042055
H 4.490693 -2.786530 -0.141915


