%chk=000026931.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000026931

0 1
 Cl   6.986000     -0.6730000      4.0399998E-02
 S  -0.3100000       2.081900      0.1989000    
 O    1.208300     -0.1485000     -0.1395000    
 N   -3.913100      0.2726000     -0.3061000    
 N    2.361400       1.759700      0.2678000    
 C   -3.821900     -0.7539000      0.7417000    
 C   -5.272000      0.8256000     -0.3911000    
 C   -4.798200      -1.900800      0.4770000    
 C   -6.295900     -0.2699000     -0.6931000    
 C   -6.228100      -1.391100      0.3375000    
 C   -2.941100       1.338500     -6.4099997E-02
 C   -1.528600      0.7687000     -0.1009000    
 C    1.225400       1.168200      0.1047000    
 C    3.241400      0.7154000      0.1171000    
 C    2.539000     -0.4544000     -0.1324000    
 C    4.641500      0.6661000      0.1749000    
 C    3.121300      -1.699600     -0.3345000    
 C    5.265800     -0.5739000     -2.4300000E-02
 C    4.518600      -1.731600     -0.2737000    
 H   -4.015000     -0.3240000       1.733300    
 H   -2.838700      -1.229600      0.7714000    
 H   -5.321800       1.568500      -1.196500    
 H   -5.545000       1.336700      0.5415000    
 H   -4.745200      -2.629400       1.294000    
 H   -4.507500      -2.427900     -0.4409000    
 H   -6.109800     -0.6811000      -1.693500    
 H   -7.304100      0.1592000     -0.7067000    
 H   -6.893400      -2.211200      4.5899998E-02
 H   -6.580300      -1.018800       1.307300    
 H   -3.135600       1.831900      0.8978000    
 H   -3.037200       2.099700     -0.8494000    
 H   -1.326000      0.3008000      -1.070700    
 H   -1.349800      3.7200000E-02  0.6889000    
 H    5.217400       1.565600      0.3686000    
 H    2.534200      -2.588900     -0.5267000    
 H    5.021700      -2.684700     -0.4256000    


%chk=000026931-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000026931

0 1
Cl 7.185317 -0.635907 -0.413326
S -0.269759 2.048501 0.729682
O 1.247070 -0.127881 -0.092705
N -3.914048 0.212944 0.021068
N 2.488429 1.740999 0.550617
C -4.253091 -0.589436 1.225713
C -5.131863 0.690550 -0.685782
C -5.112629 -1.813782 0.852242
C -6.015166 -0.498607 -1.115972
C -6.389864 -1.372828 0.102288
C -2.924172 1.278225 0.294062
C -1.505156 0.688791 0.195300
C 1.277913 1.231886 0.394321
C 3.374799 0.701763 0.158201
C 2.623319 -0.441954 -0.237125
C 4.783720 0.672252 0.115263
C 3.199431 -1.635456 -0.681197
C 5.364710 -0.530096 -0.332004
C 4.615371 -1.667493 -0.724979
H -4.809416 0.036141 1.973310
H -3.316707 -0.920646 1.711240
H -4.814240 1.268053 -1.573766
H -5.736073 1.377388 -0.036139
H -5.371611 -2.373625 1.771317
H -4.515129 -2.485026 0.205809
H -5.454973 -1.108115 -1.850993
H -6.924228 -0.115878 -1.618331
H -6.974880 -2.254743 -0.219508
H -7.036604 -0.788481 0.789368
H -3.077939 1.754863 1.293968
H -3.037637 2.074981 -0.463977
H -1.268936 0.392574 -0.836526
H -1.362861 -0.170656 0.867422
H 5.383868 1.534615 0.412251
H 2.603125 -2.500791 -0.980247
H 5.133611 -2.569128 -1.061864


