%chk=000296473.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000296473

0 1
Cl -1.009654 4.241804 -0.416146
Cl -4.046222 3.884260 -0.402789
F -2.908585 -3.908541 0.430218
F -0.981502 -3.802085 -0.440538
F -1.212885 -3.562973 1.654296
O 5.315644 1.668678 0.563705
N 3.389753 -0.303177 -0.197526
N -0.810997 -0.838142 0.226299
N -3.111140 -1.117884 0.206479
N -0.772144 1.653950 -0.093177
N -3.676667 1.309193 -0.089996
C 2.747287 -1.270637 -1.147899
C 1.221360 -1.079725 -1.173193
C 3.289728 1.108736 -0.696457
C 4.830861 -0.667483 0.016064
C 0.641844 -1.116377 0.247892
C 3.942117 2.044210 0.333160
C 5.438281 0.312048 1.033674
C -1.906841 -1.732652 0.297524
C -1.375454 0.425339 0.051825
C -2.826197 0.237329 0.050236
C -1.766856 -3.218735 0.480653
C -1.631087 2.666924 -0.227207
C -3.079642 2.491792 -0.223571
H 3.140031 -1.192279 -2.185840
H 2.984064 -2.300741 -0.797156
H 0.765858 -1.866562 -1.806258
H 0.966247 -0.113753 -1.659253
H 2.212861 1.370646 -0.803949
H 3.766235 1.250705 -1.689794
H 5.425897 -0.647468 -0.922440
H 4.878099 -1.701625 0.418056
H 1.140511 -0.333401 0.882601
H 0.843807 -2.090081 0.742401
H 4.038645 3.077305 -0.044430
H 3.400620 2.036713 1.295472
H 4.954480 0.227605 2.022771
H 6.531544 0.190181 1.128394


%chk=000296473-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000296473

0 1
Cl -0.475798 4.218497 -0.068692
Cl -3.750596 4.100461 -0.120781
F -3.130048 -3.828966 0.276042
F -1.110727 -3.760540 -0.762123
F -1.227332 -3.648159 1.501445
O 5.144832 1.906932 0.458240
N 3.358857 -0.282221 -0.238955
N -0.799735 -0.928680 0.216929
N -3.120099 -1.040021 0.166042
N -0.578676 1.535012 0.075775
N -3.461255 1.423310 0.027006
C 2.803656 -1.375895 -1.073746
C 1.261841 -1.325814 -1.171333
C 3.209057 1.065174 -0.856700
C 4.780017 -0.525169 0.129155
C 0.632664 -1.312365 0.239155
C 3.736691 2.145760 0.100774
C 5.274968 0.578913 1.077590
C -1.959426 -1.725410 0.227645
C -1.271989 0.373880 0.127206
C -2.707306 0.291189 0.102488
C -1.884723 -3.220349 0.310038
C -1.340785 2.637036 0.002569
C -2.785131 2.575677 -0.020932
H 3.226796 -1.367824 -2.109611
H 3.109053 -2.335035 -0.610996
H 0.905729 -2.198830 -1.747819
H 0.945243 -0.420627 -1.721181
H 2.141066 1.268266 -1.052504
H 3.763530 1.123422 -1.826473
H 5.438009 -0.548961 -0.775282
H 4.857425 -1.507199 0.633989
H 1.173556 -0.570917 0.852918
H 0.723366 -2.295146 0.729391
H 3.716306 3.139017 -0.376169
H 3.111780 2.163115 1.019507
H 4.691097 0.546735 2.023072
H 6.347988 0.458830 1.300421


