%chk=000212031.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000212031

0 1
Cl 6.201007 1.739443 -0.923659
Cl 7.070621 -1.197671 -0.366256
O -4.138308 -0.869057 -0.409191
O 1.426993 1.973110 0.823352
O -5.976924 -2.108791 -0.917741
N -0.918003 0.471749 0.048530
N -6.154434 -0.051815 0.210015
C -3.821224 0.415366 0.257555
C -2.923742 0.074076 1.448417
C -3.108853 1.279831 -0.784018
C -1.580475 -0.505018 0.976079
C -1.755574 0.668028 -1.181647
C -5.212151 0.984669 0.680376
C 0.465374 0.025726 -0.308334
C -5.507893 -1.117043 -0.424102
C 1.424424 0.534954 0.796081
C 2.848580 0.111832 0.505247
C 3.765442 1.033176 -0.016945
C 3.244145 -1.210329 0.763150
C 5.072377 0.619558 -0.282927
C 4.551806 -1.620413 0.493760
C 5.464428 -0.700658 -0.031724
H -3.424915 -0.660393 2.109625
H -2.746875 0.986323 2.053221
H -2.953260 2.298771 -0.375603
H -3.738283 1.387279 -1.689805
H -0.917674 -0.668545 1.852118
H -1.756401 -1.497584 0.500542
H -1.930971 -0.281069 -1.738356
H -1.221517 1.362750 -1.865174
H -5.293055 1.126509 1.778432
H -5.427622 1.965392 0.207149
H 0.567719 -1.071656 -0.436613
H 0.772769 0.480494 -1.277275
H -7.151066 0.034763 0.327103
H 1.104144 0.192643 1.808655
H 0.495898 2.300920 0.764307
H 3.452512 2.068331 -0.198330
H 2.534593 -1.924971 1.178717
H 4.863188 -2.646881 0.691868


%chk=000212031-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000212031

0 1
Cl 5.889558 2.411547 -0.776969
Cl 7.290355 -0.568251 -0.728737
O -4.284842 -0.829526 -0.332060
O 1.089276 1.561281 1.182690
O -6.353240 -1.874335 -0.733932
N -0.896177 0.196021 0.066369
N -6.181144 0.326403 0.140190
C -3.819504 0.504498 0.198299
C -2.967099 0.229280 1.452062
C -2.971188 1.168905 -0.903386
C -1.679971 -0.539799 1.101170
C -1.684523 0.370448 -1.186627
C -5.142604 1.289267 0.512448
C 0.458754 -0.374143 -0.153992
C -5.708425 -0.885121 -0.344861
C 1.410140 0.156007 0.973341
C 2.871585 -0.010057 0.584836
C 3.622643 1.108915 0.160142
C 3.485112 -1.287021 0.618202
C 4.962673 0.946971 -0.241571
C 4.826762 -1.447467 0.214211
C 5.567244 -0.327514 -0.219962
H -3.562988 -0.350177 2.181446
H -2.702870 1.198545 1.918459
H -2.704469 2.191410 -0.570955
H -3.571026 1.253737 -1.828491
H -1.057188 -0.648998 2.006457
H -1.946754 -1.559494 0.741292
H -1.957463 -0.613845 -1.630565
H -1.060483 0.914835 -1.917379
H -5.197328 1.562287 1.583465
H -5.204202 2.216746 -0.088299
H 0.467156 -1.486100 -0.185855
H 0.832998 0.000246 -1.123809
H -7.180639 0.500807 0.214488
H 1.222587 -0.417558 1.909139
H 0.122065 1.613046 0.882622
H 3.150087 2.094370 0.168451
H 2.924834 -2.162416 0.967119
H 5.307093 -2.429949 0.237149


