%chk=000068851.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000068851

0 1
 Cl   2.919500      -3.848000      0.2129000    
 S    2.334800      0.5391000      -2.604700    
 O    1.566900      6.7500003E-02   2.648000    
 O    4.323000       1.671300     -0.4554000    
 N   -1.392300      -1.142200      0.3581000    
 N    2.382000       2.032500      0.7710000    
 N   0.4018000     -0.4016000      -1.020900    
 N    2.451100      -1.666600      -1.104700    
 C   -3.737500     -0.4767000      0.2192000    
 C   -2.376100     -0.1651000      0.1357000    
 C   -4.699700      0.5083000     -3.8000001E-03
 C   -1.988500       1.143100     -0.1734000    
 C   -4.306100       1.810700     -0.3115000    
 C   -4.163800      -1.872300      0.5505000    
 C   -2.950700       2.128100     -0.3963000    
 C   -6.157600      0.1957000      8.2599998E-02
 C  -8.0499999E-02  -1.310900     -0.1485000    
 C    2.966200       1.925000       2.088700    
 C   0.6329000      -2.408800      0.2870000    
 C    2.277700       2.069000      -1.641400    
 C    1.652000     -0.6434000      -1.446200    
 C    3.115200       1.895500     -0.3963000    
 C    2.923600      0.4866000       2.579100    
 C    1.906000      -2.537100     -0.2299000    
 H  -0.9470000       1.445300     -0.2078000    
 H   -5.042200       2.590900     -0.4864000    
 H   -1.729200      -1.966600      0.8458000    
 H   -5.217200      -2.080200      0.3489000    
 H   -3.610300      -2.600100     -5.3800002E-02
 H   -3.983200      -2.076600       1.611300    
 H   -2.644500       3.144600     -0.6263000    
 H   -6.769000       1.098100     -3.2299999E-02
 H   -6.453700     -0.4944000     -0.7143000    
 H   -6.409900     -0.2301000       1.059500    
 H    2.376400       2.572000       2.745900    
 H    3.998200       2.288800       2.061900    
 H   0.2257000      -3.125800      0.9902000    
 H    1.240600       2.328100      -1.410900    
 H    2.702900       2.887200      -2.230800    
 H    1.382700       2.205200      0.7165000    
 H    3.459400     -0.1820000       1.897700    
 H    3.364800      0.4102000       3.577300    
 H    1.568500     -0.8526000       2.962700    


%chk=000068851-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000068851

0 1
Cl 2.929244 -4.800565 -1.289024
S 3.433916 0.532650 -1.444029
O 0.476604 -0.582331 2.614793
O 2.501269 3.417000 0.687496
N -1.151481 -1.625612 -0.617610
N 0.996399 1.621684 0.751356
N 0.985588 -0.677669 -1.036092
N 2.938756 -2.092096 -1.340593
C -2.826825 -0.180496 0.449457
C -1.902726 -0.401590 -0.614671
C -3.635410 0.994934 0.418677
C -1.769721 0.517588 -1.682659
C -3.484540 1.914821 -0.649685
C -2.888534 -1.175857 1.597067
C -2.555971 1.684630 -1.688384
C -4.644079 1.292087 1.517469
C 0.193727 -1.789954 -0.879614
C 0.603131 1.794897 2.149799
C 0.757133 -3.104967 -0.956533
C 2.242657 2.010091 -1.309758
C 2.310416 -0.881432 -1.254890
C 1.935700 2.420184 0.137887
C 1.135993 0.672603 3.047075
C 2.138276 -3.161854 -1.186539
H -1.064683 0.310859 -2.492001
H -4.101825 2.820394 -0.664395
H -1.646201 -2.462109 -0.302319
H -3.564598 -0.837387 2.396619
H -3.257599 -2.171805 1.273614
H -1.881376 -1.307199 2.036711
H -2.457437 2.404873 -2.507532
H -5.197128 2.220815 1.297957
H -5.385778 0.479047 1.628720
H -4.154628 1.421997 2.501666
H -0.500641 1.822716 2.226680
H 1.006014 2.763714 2.494777
H 0.151059 -4.006155 -0.848319
H 1.332607 1.741638 -1.869617
H 2.781631 2.828606 -1.808813
H 0.656359 0.801245 0.221656
H 2.235896 0.595973 2.936105
H 0.886007 0.890623 4.106409
H 0.955703 -1.354894 3.005985


