%chk=000180049.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000180049

0 1
Cl -4.272348 0.848605 -1.884712
S 0.788570 1.585732 0.099279
F 4.785605 -0.183770 -0.432995
F 3.438243 1.326499 -1.003147
F 3.874610 0.994939 1.063331
O -0.426826 1.806908 0.863208
O 2.016708 2.215285 0.541426
O -1.453243 -0.175103 -1.951636
N -1.301501 -0.712910 0.273948
N -1.805079 -0.801918 1.520158
N -5.173159 0.578963 1.024706
C 1.123444 -0.157504 0.070819
C 0.105779 -1.109325 0.171455
C 2.447388 -0.618470 -0.003377
C 0.374904 -2.491079 0.187215
C 2.735851 -1.985763 0.018088
C 1.695531 -2.921027 0.109463
C 0.469197 1.994673 -1.557166
C 3.605151 0.366140 -0.082236
C -2.033334 -0.190617 -0.886132
C -3.376415 0.232620 -0.575497
C -3.892474 0.184031 0.708686
C -3.033873 -0.391464 1.749005
H -0.443912 -3.208957 0.268213
H 3.765187 -2.349964 -0.029195
H 0.248005 1.131298 -2.215237
H -0.420333 2.637526 -1.673214
H 1.285926 2.544453 -2.047984
H 1.926167 -3.988741 0.123432
H -3.402446 -0.486240 2.777656
H -5.728058 1.084716 0.347686
H -5.443066 0.696461 1.987553


%chk=000180049-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000180049

0 1
Cl -4.183397 1.059089 -1.916815
S 0.808348 1.786486 0.102395
F 4.525960 -0.732763 -1.366597
F 3.318711 1.159240 -1.527457
F 4.446856 0.667665 0.390886
O -0.632261 1.988664 0.847597
O 2.145027 2.377257 0.823317
O -1.217637 0.212088 -1.767155
N -1.308973 -0.665738 0.417395
N -1.965914 -1.027432 1.568503
N -5.339521 0.256110 0.821017
C 1.128810 -0.170188 0.002986
C 0.081645 -1.050338 0.370073
C 2.450248 -0.667901 -0.135517
C 0.376169 -2.392360 0.708498
C 2.721182 -2.022435 0.184855
C 1.694245 -2.870614 0.637105
C 0.641617 2.542917 -1.650465
C 3.649993 0.120650 -0.628903
C -1.914100 -0.025040 -0.733619
C -3.318286 0.248897 -0.553465
C -4.012486 -0.044511 0.625467
C -3.255193 -0.719431 1.663821
H -0.448354 -3.039009 1.021343
H 3.737725 -2.404857 0.060492
H -0.103779 1.922822 -2.166420
H 0.289901 3.563576 -1.441437
H 1.641140 2.514643 -2.096530
H 1.918661 -3.907184 0.904332
H -3.733959 -1.012035 2.603397
H -5.860286 0.742309 0.092315
H -5.801890 0.045420 1.701384


