%chk=000001791.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000001791

0 1
 Cl   2.737200      -2.681700     -0.9078000    
 O    1.601700      3.3799998E-02  -1.532300    
 O    7.411900       1.351000      0.5488000    
 O   -8.515800     -0.6877000       1.415400    
 N    7.581500     -0.9176000      0.7883000    
 N   -9.776600      -1.138000       1.043400    
 C   -3.188600      0.1620000     -0.4237000    
 C   -4.286400      0.8888000      0.3562000    
 C   -1.818400      0.7950000     -0.1761000    
 C   -5.662100      0.2738000      8.0600001E-02
 C  -0.7276000      9.0899996E-02 -0.9801000    
 C   -6.794100      0.9488000      0.8633000    
 C   0.6324000      0.7420000     -0.7722000    
 C   -8.147000      0.3346000      0.6019000    
 C    8.819500     -0.3160000       1.311000    
 C    8.787200       1.115600      0.8150000    
 C    6.872000      0.1123000      0.4467000    
 C    5.496200      8.3400004E-02 -6.9700003E-02
 C    2.884600      3.0200001E-02  -1.049400    
 C   -9.139100      0.5787000     -0.3105000    
 C    10.02860      -1.091400      0.8237000    
 C    4.836200      -1.134900     -0.2304000    
 C    4.850400       1.275200     -0.3988000    
 C    3.530300      -1.161500     -0.7201000    
 C    3.544700       1.248500     -0.8889000    
 C   -10.12840     -0.3668000      1.0800000E-02
 C   -11.43030     -0.5689000     -0.6452000    
 H   -3.418800      0.1943000      -1.495600    
 H   -3.164700     -0.8944000     -0.1297000    
 H   -4.070300      0.8380000       1.430100    
 H   -4.299700       1.949400      7.7600002E-02
 H   -1.578200      0.7469000      0.8929000    
 H   -1.850100       1.855900     -0.4530000    
 H   -5.878400      0.3339000     -0.9939000    
 H   -5.638500     -0.7946000      0.3319000    
 H  -0.9744000      0.1028000      -2.049100    
 H  -0.6722000     -0.9677000     -0.6969000    
 H   -6.582700      0.8953000       1.938300    
 H   -6.836700       2.013200      0.6021000    
 H   0.8861000      0.7267000      0.2958000    
 H   0.6072000       1.783900      -1.111200    
 H    8.783400     -0.3419000       2.407000    
 H    9.354600       1.270300     -0.1092000    
 H    9.147400       1.818400       1.572400    
 H   -9.143200       1.327100      -1.089100    
 H    10.06540      -1.128200     -0.2707000    
 H    9.993600      -2.125200       1.183700    
 H    10.95580     -0.6344000       1.183500    
 H    5.333200      -2.068200      2.4300000E-02
 H    5.333900       2.241700     -0.2883000    
 H    3.058500       2.184700      -1.149400    
 H   -11.57400      0.1354000      -1.471000    
 H   -12.24950     -0.4223000      6.6399999E-02
 H   -11.50560      -1.582400      -1.052600    


%chk=000001791-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000001791

0 1
Cl 3.286082 -3.285365 -0.589537
O 1.597811 -0.910435 -0.076559
O 7.586875 1.424158 0.788971
O -8.725095 -0.202017 0.989841
N 8.133221 -0.790443 0.287881
N -10.092989 -0.682528 0.721988
C -3.322672 -0.085414 -0.057587
C -4.470416 0.935328 0.110476
C -1.922788 0.543450 0.124285
C -5.867420 0.297389 -0.048132
C -0.781358 -0.483160 -0.059842
C -7.009526 1.339732 0.110763
C 0.594086 0.153516 0.143991
C -8.379918 0.740372 0.010589
C 9.453307 -0.106671 0.509057
C 9.084264 1.383838 0.837806
C 7.187748 0.099068 0.448810
C 5.740005 -0.116554 0.320386
C 2.941104 -0.584927 0.066875
C -9.446205 0.886484 -0.861858
C 10.360203 -0.260822 -0.725416
C 5.260374 -1.409951 -0.025396
C 4.814742 0.933109 0.535094
C 3.885675 -1.629504 -0.147523
C 3.430631 0.702829 0.409601
C -10.476581 -0.004813 -0.388178
C -11.846602 -0.238438 -0.971186
H -3.388104 -0.550704 -1.062677
H -3.452765 -0.907580 0.675598
H -4.395407 1.409760 1.111398
H -4.348167 1.751315 -0.632531
H -1.857185 0.998044 1.135000
H -1.798742 1.373833 -0.602054
H -5.949798 -0.184502 -1.042492
H -6.003944 -0.501964 0.704746
H -0.825508 -0.923155 -1.074108
H -0.900219 -1.316891 0.657746
H -6.899130 1.842016 1.092666
H -6.913239 2.121953 -0.664584
H 0.701387 0.552971 1.173784
H 0.766177 0.976434 -0.580532
H 9.940815 -0.591827 1.376169
H 9.459117 2.094877 0.081268
H 9.389530 1.704795 1.847043
H -9.501128 1.539586 -1.729395
H 9.901133 0.217980 -1.609057
H 10.511191 -1.329257 -0.955109
H 11.348951 0.201412 -0.546787
H 5.977041 -2.219144 -0.190918
H 5.186488 1.926457 0.800764
H 2.732256 1.526680 0.579624
H -11.997787 0.385580 -1.866760
H -12.635742 0.007863 -0.239493
H -11.979679 -1.296063 -1.258307


