%chk=000183324.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000183324

0 1
Cl -3.971380 1.625822 -2.114101
N 0.364845 1.566134 0.328550
N -2.426566 -2.292523 0.593175
N -0.997959 -0.386853 0.543568
N -1.673558 1.532158 -0.843877
N -3.163728 -0.375479 -0.618838
C 1.483766 0.970238 1.116698
C 2.514853 0.410295 0.148545
C 2.040874 2.041623 2.056046
C 3.574000 1.184182 -0.341694
C 2.372898 -0.919673 -0.278137
C -0.773515 0.868759 0.005727
C 4.493396 0.628146 -1.237188
C 3.291762 -1.471565 -1.173403
C -2.200779 -0.989355 0.194835
C 4.355691 -0.699351 -1.652362
C -1.581316 -2.890348 1.653541
C -3.778856 -2.880512 0.440632
C -2.821820 0.851974 -1.093957
H 1.070821 0.127264 1.745261
H 0.536973 2.453290 -0.148138
H 2.896000 1.649886 2.622219
H 1.282516 2.363075 2.782671
H 2.383699 2.939832 1.529275
H 3.689235 2.220890 -0.030590
H 1.533114 -1.518373 0.080378
H 5.316456 1.233396 -1.613355
H 3.176653 -2.503125 -1.502286
H 5.071600 -1.130391 -2.349758
H -1.891404 -2.571149 2.662734
H -0.523043 -2.592223 1.516812
H -1.632477 -3.989410 1.591428
H -4.453438 -2.594518 1.264494
H -3.701181 -3.978422 0.396982
H -4.245734 -2.536895 -0.506482


%chk=000183324-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000183324

0 1
Cl -4.150071 1.209571 -2.393883
N 0.451197 0.842995 -0.405829
N -2.923491 -1.955922 1.345093
N -1.189082 -0.571424 0.529430
N -1.703843 0.980481 -1.292778
N -3.440626 -0.457340 -0.404838
C 1.521961 0.377332 0.505959
C 2.851579 0.332768 -0.262497
C 1.537549 1.214157 1.804656
C 4.038784 0.926687 0.230888
C 2.902710 -0.356176 -1.504456
C -0.838580 0.395001 -0.370200
C 5.248357 0.835579 -0.497541
C 4.106946 -0.447697 -2.233487
C -2.501472 -0.979603 0.477570
C 5.287826 0.149209 -1.731028
C -2.007271 -2.567931 2.317859
C -4.313225 -2.439047 1.342686
C -2.951281 0.489959 -1.221056
H 1.236726 -0.656800 0.780927
H 0.648628 1.584580 -1.081341
H 2.263296 0.806057 2.531047
H 0.536848 1.180209 2.267411
H 1.793822 2.270343 1.605428
H 4.029574 1.465157 1.183885
H 1.989285 -0.818259 -1.897860
H 6.157231 1.302167 -0.101061
H 4.126684 -0.983055 -3.189346
H 6.224562 0.079989 -2.295118
H -2.386356 -2.417064 3.346984
H -1.017537 -2.101429 2.219154
H -1.922008 -3.656308 2.133227
H -4.783341 -2.256669 2.328258
H -4.338685 -3.526466 1.137116
H -4.874296 -1.904254 0.564143


