%chk=000296604.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000296604

0 1
Cl 3.211448 2.998384 -0.468937
P 2.323039 0.134822 0.451755
O 2.006460 -0.628955 1.692775
N 0.969372 0.590440 -0.551944
N 3.483030 -0.631145 -0.613196
C -0.432778 0.203572 -0.183475
C -2.002855 -1.690304 0.367791
C -2.414597 0.606106 1.327529
C -2.779842 0.179863 -1.130421
C -0.530287 -1.315075 0.101790
C -0.942876 0.987854 1.057146
C -1.313016 0.560837 -1.416086
C -2.510210 -0.910694 1.601013
C -2.870968 -1.336539 -0.858285
C -3.282645 0.962569 0.101488
C 3.215803 1.791175 0.832340
C 3.356697 -2.114423 -0.676928
C 2.312644 -2.615964 -1.675472
H -2.069357 -2.783425 0.566880
H -2.779646 1.167263 2.216646
H -3.404798 0.437193 -2.014671
H 0.078659 -1.590719 0.991575
H -0.118300 -1.897301 -0.748181
H -0.850127 2.074125 0.900993
H -0.332550 0.743571 1.947982
H -0.943673 0.024423 -2.308208
H -1.241452 1.636507 -1.649821
H -3.550688 -1.194016 1.833090
H -1.910390 -1.175682 2.490482
H -2.534970 -1.905208 -1.742251
H -3.919786 -1.631019 -0.681255
H -4.341029 0.721227 0.301099
H -3.244975 2.048139 -0.092358
H 1.006093 1.522143 -1.002306
H 2.750883 2.241516 1.729426
H 4.270426 1.561375 1.086265
H 3.562979 -0.224844 -1.563735
H 4.363902 -2.505378 -0.960403
H 3.148711 -2.527015 0.341342
H 1.284813 -2.326069 -1.389794
H 2.485859 -2.225522 -2.683886
H 2.327900 -3.709806 -1.740392


%chk=000296604-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000296604

0 1
Cl 3.423856 2.765239 -1.156205
P 2.222749 0.218155 0.277797
O 2.159122 -0.456094 1.740119
N 0.794388 0.881786 -0.455148
N 2.834803 -0.876520 -0.911262
C -0.588367 0.402422 -0.168429
C -2.124532 -1.613335 0.025115
C -2.527587 0.414888 1.493385
C -2.992485 0.538400 -0.996893
C -0.663229 -1.148864 -0.230496
C -1.067139 0.877060 1.238382
C -1.529793 0.998396 -1.251595
C -2.587779 -1.135488 1.428134
C -3.057949 -1.011724 -1.060050
C -3.455969 1.019333 0.405403
C 3.365429 1.721161 0.413047
C 3.704796 -2.025273 -0.600719
C 3.111644 -3.356299 -1.106428
H -2.162741 -2.719417 -0.022630
H -2.851675 0.758437 2.495493
H -3.648173 0.972914 -1.777101
H 0.011430 -1.586462 0.531527
H -0.316210 -1.492637 -1.224892
H -1.000130 1.983502 1.289362
H -0.384028 0.464518 2.005723
H -1.188192 0.672738 -2.253581
H -1.472974 2.107355 -1.224204
H -3.621682 -1.484710 1.622960
H -1.938115 -1.572630 2.211652
H -2.752132 -1.365539 -2.065379
H -4.099738 -1.352749 -0.895857
H -4.504885 0.707792 0.581916
H -3.430506 2.126724 0.455980
H 0.865465 1.862887 -0.748633
H 3.008890 2.375261 1.221641
H 4.389769 1.370448 0.605264
H 2.489082 -0.766509 -1.866068
H 4.715508 -1.876576 -1.034655
H 3.813832 -2.062803 0.499127
H 2.134588 -3.548282 -0.629862
H 2.966609 -3.336952 -2.203436
H 3.790953 -4.196551 -0.871097


