%chk=000020460.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000020460

0 1
 Cl -0.5506000      -4.397400     -1.3400000E-02
 O   -2.372600      0.1699000     -1.4200000E-02
 N    2.259400     -0.3250000      3.0800000E-02
 N  -6.7800000E-02 -3.5100002E-02  7.3000002E-03
 N   0.8958000      -2.232600      8.9999996E-03
 N   -1.489000      -1.968300     -1.5900001E-02
 C    2.511700       1.095900      3.8600001E-02
 C    4.009700       1.378500     -7.0000002E-03
 C   -3.467300       2.297900      8.6000003E-03
 C   -2.132100       1.569700     -3.8000001E-03
 C    4.328700       2.866700     -4.6100002E-02
 C   0.9899000     -0.8814000      1.5400000E-02
 C   -3.288500       3.805500      5.1000002E-03
 C   -1.264200     -0.6445000     -8.0000004E-03
 C  -0.3631000      -2.699800     -6.3999998E-03
 H    2.082300       1.545600      0.9418000    
 H    2.030600       1.563100     -0.8293000    
 H    4.449800      0.8976000     -0.8894000    
 H    4.496500      0.9301000      0.8678000    
 H   -4.061400       1.992200     -0.8610000    
 H   -4.044600       1.993200      0.8898000    
 H    3.040500     -0.9709000      4.2100001E-02
 H   -1.567800       1.858700     -0.8993000    
 H   -1.560600       1.847000      0.8911000    
 H    3.891600       3.336700     -0.9328000    
 H    3.936000       3.373400      0.8411000    
 H    5.411600       3.022200     -7.6600000E-02
 H   -2.748100       4.134700     -0.8882000    
 H   -4.263300       4.303000      1.4600000E-02
 H   -2.729900       4.136500      0.8864000    


%chk=000020460-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000020460

0 1
Cl -0.579268 -4.460631 0.007845
O -2.372066 0.198381 0.003547
N 2.304996 -0.344723 0.015878
N -0.023453 0.025171 0.012698
N 0.921997 -2.231238 0.014157
N -1.484806 -1.926161 0.008291
C 2.623456 1.093866 0.020294
C 4.148055 1.310176 -0.032350
C -3.602598 2.281045 0.000323
C -2.196350 1.682864 0.003218
C 4.510199 2.809705 -0.022350
C 1.041066 -0.847821 0.014157
C -3.551490 3.825121 -0.002381
C -1.245567 -0.573763 0.009425
C -0.352251 -2.659474 0.012246
H 2.198486 1.563607 0.928820
H 2.133426 1.579326 -0.845405
H 4.555792 0.834070 -0.946135
H 4.621732 0.807730 0.834713
H -4.149150 1.914291 -0.887795
H -4.151613 1.917423 0.888201
H 3.058814 -1.034896 0.021327
H -1.614520 1.969200 -0.892337
H -1.617384 1.970140 0.900261
H 4.072557 3.331135 -0.893518
H 4.134539 3.304082 0.892486
H 5.604253 2.952913 -0.058226
H -3.026491 4.210128 -0.896634
H -4.571140 4.248038 -0.004015
H -3.028021 4.213396 0.891358


