%chk=000042592.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000042592

0 1
 Cl  -7.371300     -0.5335000       2.572300    
 O   0.1232000      -4.406400     -0.9754000    
 O   -2.968200       2.597800      -1.277400    
 O    2.298300      0.8103000       1.033800    
 O    5.052800     -0.7059000      0.8903000    
 O    5.861800       1.287500       1.716900    
 N   -1.579600      0.8550000     -0.8802000    
 N    4.608700       3.882300     -0.2591000    
 C   0.6266000      0.5314000      -1.170400    
 C   1.4800000E-02 -0.7385000      -1.054000    
 C  -0.3589000       1.479200      -1.055100    
 C   -1.358600     -0.5266000     -0.8695000    
 C    2.067800      0.7913000      -1.374200    
 C   0.5167000      -2.056400      -1.088100    
 C   -2.240500      -1.615500     -0.7289000    
 C  -0.1863000       2.950600      -1.109200    
 C   -2.811400       1.523100     -0.7072000    
 C    2.843300      0.9327000     -6.3900001E-02
 C  -0.3600000      -3.133300     -0.9425000    
 C   -1.720000      -2.913200     -0.7664000    
 C    4.326900       1.265600     -0.1772000    
 C   -3.936100       1.015700      0.1023000    
 C   -5.243600       1.345800     -0.2452000    
 C   -3.684900      0.2092000       1.209200    
 C    5.167000      0.6562000      0.9310000    
 C    4.485300       2.729100     -0.2205000    
 C   -6.307000      0.8661000      0.5194000    
 C   -4.748500     -0.2707000       1.973800    
 C    1.529000      -4.561800      -1.159200    
 C   -6.059500      5.7799999E-02   1.628900    
 C    5.823900      -1.419900       1.861700    
 C    5.588000      -2.904700       1.684200    
 H    2.524300     -3.0500000E-02  -1.938100    
 H    2.219700       1.701100      -1.965000    
 H    1.585100      -2.168900      -1.227400    
 H   -3.314900      -1.493700     -0.6687000    
 H  -0.7413000       3.445200     -0.3052000    
 H  -0.5300000       3.343700      -2.071300    
 H   0.8592000       3.248800     -0.9855000    
 H   -2.399300      -3.757300     -0.6727000    
 H    4.706300      0.8432000      -1.116200    
 H   -5.457900       1.969000      -1.109300    
 H   -2.675200     -1.9600000E-02   1.537900    
 H   -7.323500       1.129000      0.2381000    
 H   -4.540100     -0.8898000       2.842600    
 H    1.737600      -5.636800      -1.159300    
 H    1.853900      -4.174300      -2.130900    
 H    2.095000      -4.127800     -0.3277000    
 H    5.516500      -1.114200       2.868000    
 H    6.887000      -1.194600       1.721500    
 H    6.162400      -3.482400       2.413700    
 H    4.525500      -3.142700       1.801600    
 H    5.874800      -3.222600      0.6762000    


%chk=000042592-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000042592

0 1
Cl -7.294409 -0.798896 2.875364
O 0.503132 -4.144725 -1.062488
O -3.306430 2.615590 -1.455358
O 2.515982 0.717280 1.028027
O 5.053061 -1.100581 0.844030
O 5.867153 0.980169 1.538922
N -1.699379 1.024425 -0.843569
N 5.386116 3.009197 -1.552055
C 0.573625 0.950298 -1.131360
C 0.085465 -0.417211 -1.034143
C -0.516048 1.809871 -1.035901
C -1.329947 -0.361108 -0.859796
C 2.016690 1.328372 -1.307360
C 0.754431 -1.664768 -1.105748
C -2.105959 -1.540573 -0.820335
C -0.545644 3.310790 -1.039639
C -3.019241 1.569628 -0.805942
C 2.915864 0.921106 -0.132903
C -0.021702 -2.840932 -1.023282
C -1.439648 -2.776434 -0.896294
C 4.451233 0.752791 -0.496918
C -4.027222 0.904160 0.078299
C -5.398936 1.027146 -0.264969
C -3.665144 0.275683 1.299368
C 5.228182 0.272546 0.740476
C 4.988018 1.993139 -1.071482
C -6.399502 0.502397 0.576126
C -4.657621 -0.237227 2.159860
C 1.954692 -4.281052 -1.184086
C -6.010183 -0.124036 1.778560
C 5.589849 -1.742129 2.090597
C 5.174039 -3.207399 2.043122
H 2.437220 0.888392 -2.235278
H 2.132229 2.423667 -1.431882
H 1.841564 -1.705940 -1.220868
H -3.194129 -1.520338 -0.731318
H -1.101392 3.710052 -0.171967
H -1.044669 3.707290 -1.939770
H 0.481218 3.709758 -0.993365
H -1.996905 -3.716800 -0.858895
H 4.500628 -0.045348 -1.264270
H -5.667540 1.546258 -1.190408
H -2.611886 0.196327 1.585441
H -7.457019 0.582982 0.310341
H -4.386155 -0.711917 3.106733
H 2.144980 -5.364256 -1.171761
H 2.321949 -3.850312 -2.136663
H 2.478756 -3.798911 -0.334560
H 5.163820 -1.203957 2.955439
H 6.686241 -1.607637 2.096465
H 5.545708 -3.727067 2.944598
H 4.074823 -3.302946 2.019117
H 5.594844 -3.711714 1.156244


