%chk=000088895.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000088895

0 1
 Cl  -3.025900      0.2784000       3.186400    
 O    2.756300       1.710600       1.907500    
 O    3.838200       1.739200      -1.349900    
 O    6.016700      -2.365500       1.464100    
 O    2.355600      -3.758600      -1.596700    
 O    4.564300       3.834200      -1.998700    
 O   -2.779200       1.667500      -2.455100    
 O   -2.617600     -0.5192000      -2.559300    
 O   -7.839700      0.1121000     -0.7987000    
 O   -7.906800      3.9999999E-04   1.392600    
 N    4.422700     -0.1853000      0.6644000    
 N   0.4835000      -2.565500     -0.8043000    
 N   -1.158400     -0.6356000      0.4626000    
 N   -1.669700      0.5070000      0.5053000    
 N   -3.005900      0.5267000      -1.988600    
 N   -7.267200      0.1003000      0.3178000    
 C    3.015800     -0.2948000      0.6163000    
 C    5.191400     -8.0899999E-02 -0.5590000    
 C    5.114500     -0.1903000       1.937100    
 C    2.208000      0.6562000       1.240000    
 C    2.434800      -1.365700     -6.2899999E-02
 C    5.176000       1.352800      -1.061600    
 C    1.046200      -1.485600     -0.1186000    
 C    5.287700      -1.617200       2.429000    
 C   0.8192000      0.5361000       1.185000    
 C   0.2384000     -0.5347000      0.5055000    
 C    1.145000      -3.598500      -1.478800    
 C    1.853700       2.632700       2.514300    
 C    3.674500       3.014800      -1.814300    
 C   -3.070800      0.4054000      0.4621000    
 C   0.1736000      -4.575500      -2.092100    
 C   -3.729000      0.4151000     -0.7679000    
 C    2.222500       3.280100      -2.073900    
 C   -3.803100      0.2943000       1.644000    
 C   -5.119500      0.3140000     -0.8159000    
 C   -5.851700      0.2026000      0.3663000    
 C   -5.193500      0.1927000       1.596100    
 H    4.792100     -0.7471000      -1.332400    
 H    6.230700     -0.3884000     -0.3944000    
 H    4.597700      0.3935000       2.704300    
 H    6.103100      0.2705000       1.818000    
 H    3.112600      -2.079500     -0.5075000    
 H    5.780600       1.425500      -1.973000    
 H    5.593300       2.025400     -0.3023000    
 H    5.845500      -1.628000       3.370600    
 H    4.321100      -2.106100       2.588700    
 H   0.1697000       1.241800       1.689500    
 H  -0.5342000      -2.591800     -0.8061000    
 H    6.110100      -3.267800       1.814500    
 H    2.462100       3.408200       2.991400    
 H    1.266200       2.161100       3.309600    
 H    1.228500       3.138100       1.770200    
 H  -0.4981000      -4.051400      -2.777900    
 H  -0.4118000      -5.057200      -1.303900    
 H   0.7201000      -5.341700      -2.648800    
 H    1.660200       3.205000      -1.139800    
 H    1.841400       2.568200      -2.810300    
 H    2.103700       4.291200      -2.473700    
 H   -5.613100      0.3237000      -1.785800    
 H   -5.746500      0.1068000       2.529000    


%chk=000088895-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000088895

0 1
Cl -3.823844 -0.200599 3.998811
O 2.577449 0.899610 3.167953
O 4.753695 0.662179 -2.115220
O 6.673758 -0.486927 2.640530
O 1.957037 -1.275266 -3.093007
O 6.241633 0.123743 -3.836254
O -2.820671 1.344046 -1.437979
O -3.166554 -0.790546 -2.179242
O -8.201179 -0.696912 -0.642102
O -8.529241 -0.749283 1.621787
N 4.222480 0.215105 0.927822
N 0.170508 -0.949465 -1.613091
N -1.372538 -0.307040 0.475358
N -2.166312 -0.014696 1.508292
N -3.287282 0.153083 -1.298111
N -7.771221 -0.643575 0.577982
C 2.838653 0.142868 0.849992
C 5.101089 -0.560485 0.004997
C 4.969651 1.069328 1.885508
C 1.958006 0.494459 1.971863
C 2.221671 -0.339297 -0.348971
C 5.767519 0.239538 -1.119955
C 0.830171 -0.491648 -0.460015
C 5.539429 0.333953 3.107660
C 0.581261 0.363998 1.853736
C -0.019988 -0.131833 0.657043
C 0.712632 -1.320782 -2.846306
C 1.702655 1.204410 4.309197
C 5.118919 0.540261 -3.478253
C -3.525353 -0.113437 1.216084
C -0.309078 -1.803085 -3.865466
C -4.113653 -0.126728 -0.099982
C 3.970607 0.946950 -4.363812
C -4.455650 -0.223423 2.302201
C -5.478922 -0.323808 -0.327071
C -6.327995 -0.452567 0.791604
C -5.829352 -0.390109 2.114521
H 4.538240 -1.407658 -0.416249
H 5.912048 -0.966080 0.639520
H 4.322344 1.884525 2.231352
H 5.820136 1.519536 1.339208
H 2.827857 -0.529404 -1.233864
H 6.527281 -0.385705 -1.624110
H 6.263106 1.151787 -0.741475
H 5.887674 1.095105 3.837788
H 4.753723 -0.287331 3.575777
H -0.099977 0.594924 2.676270
H -0.853980 -0.990261 -1.510040
H 7.040652 -1.016791 3.390597
H 2.384208 1.492881 5.122591
H 1.113991 0.315725 4.604336
H 1.020767 2.042066 4.072095
H -1.327511 -1.434157 -3.660441
H -0.330405 -2.908851 -3.865880
H 0.008625 -1.479163 -4.869065
H 3.537600 1.903149 -4.026186
H 3.179898 0.177816 -4.285421
H 4.315159 1.027524 -5.404828
H -5.897490 -0.353792 -1.336508
H -6.518339 -0.487564 2.956425


