%chk=000157595.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000157595

0 1
 Cl   6.353900       4.001900      0.3151000    
 O   0.4803000      -4.483400     -0.1547000    
 N   0.7283000      0.5095000     -0.9766000    
 N   -3.208100       1.328200      0.5537000    
 N    4.453000     -0.6982000      0.5185000    
 N   -5.200400       2.124200       1.098100    
 N   -3.848900     -0.7020000     -0.6092000    
 N   -6.276500     -0.9478000     -0.6583000    
 N   -7.750500      0.6546000      0.3348000    
 C   -1.231700       1.933100     -0.8152000    
 C   0.2879000       1.863300     -0.9318000    
 C   -1.754200       1.247700      0.4491000    
 C    1.991500      9.9600002E-02 -0.4705000    
 C    2.207800      -1.244800     -0.1516000    
 C    3.007300       1.044700     -0.2945000    
 C    3.471300      -1.604400      0.3470000    
 C    4.239500      0.5955000      0.2098000    
 C   -4.098800      0.4314000      6.3699998E-02
 C    1.205100      -2.215800     -0.3184000    
 C   -3.900900       2.325600       1.165600    
 C   -5.338200      0.9438000      0.4119000    
 C    2.817700       2.402300     -0.6065000    
 C    3.692700      -2.941500      0.6664000    
 C    5.254700       1.531700      0.3875000    
 C    1.451900      -3.545800      8.5000005E-03
 C    2.698400      -3.909000      0.5020000    
 C    3.848700       3.318100     -0.4197000    
 C    5.069600       2.881400      7.8299999E-02
 C   -6.454100      0.2085000      2.4900001E-02
 C   -5.003700      -1.325700     -0.9289000    
 C   0.8063000      -5.826600      0.2008000    
 H   -1.690900       1.464900      -1.696200    
 H   -1.547400       2.984200     -0.8242000    
 H   0.4929000       2.367500      -1.882900    
 H   0.5976000       2.399600     -2.7500000E-02
 H   -1.489000      0.1851000      0.4787000    
 H   -1.340000       1.717300       1.349100    
 H   0.1370000     -0.1757000      -1.427800    
 H   0.2130000      -1.975000     -0.6887000    
 H   -3.420800       3.170400       1.640400    
 H    2.064500       2.889600      -1.186000    
 H    4.661800      -3.250000       1.054900    
 H    6.216000       1.199100      0.7777000    
 H    2.967300      -4.922700      0.7788000    
 H    3.705200       4.357600     -0.7042000    
 H   -4.899000      -2.255900      -1.477200    
 H   -7.885600       1.517100      0.8448000    
 H   -8.545500      0.1026000      4.3000001E-02
 H    1.029800      -5.916600       1.269200    
 H    1.611600      -6.224200     -0.4261000    
 H  -8.1699997E-02  -6.437100      7.0000002E-03


%chk=000157595-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000157595

0 1
Cl 7.309524 3.105366 -0.507583
O -0.562753 -3.853999 0.268012
N 0.572318 1.067556 -0.078528
N -3.397271 1.896499 0.392072
N 4.301320 -1.083793 -0.286082
N -5.660750 1.531838 0.239509
N -2.591263 -0.446847 0.208115
N -4.451369 -2.040098 -0.014245
N -6.718264 -1.378764 -0.079144
C -1.275840 2.537341 -0.803263
C 0.238840 2.430466 -0.536069
C -2.092215 2.561392 0.521731
C 1.808804 0.431122 -0.097731
C 1.817167 -1.022185 -0.033871
C 3.082875 1.105911 -0.179306
C 3.090924 -1.714240 -0.134575
C 4.291239 0.280977 -0.296532
C -3.561025 0.516025 0.247369
C 0.625563 -1.802148 0.100679
C -4.687405 2.451571 0.377877
C -4.963780 0.310752 0.158747
C 3.272386 2.534185 -0.110343
C 3.102397 -3.148969 -0.089708
C 5.579991 0.920027 -0.414500
C 0.679830 -3.198894 0.139235
C 1.932268 -3.889721 0.044763
C 4.528476 3.129365 -0.198855
C 5.676447 2.297267 -0.369887
C -5.397182 -1.040647 0.019477
C -3.129523 -1.703840 0.079187
C -0.568012 -5.317870 0.329628
H -1.597410 1.677740 -1.418835
H -1.481035 3.450709 -1.389712
H 0.802602 2.668752 -1.458603
H 0.512841 3.192289 0.223549
H -1.530401 2.037993 1.317266
H -2.264450 3.596922 0.861919
H -0.248378 0.459161 0.033271
H -0.366504 -1.347382 0.187656
H -4.852504 3.522896 0.475640
H 2.424712 3.199474 0.047935
H 4.080274 -3.633459 -0.166733
H 6.450212 0.268082 -0.519780
H 1.977591 -4.982226 0.075585
H 4.641226 4.214894 -0.131808
H -2.418394 -2.535634 0.053667
H -7.431984 -0.653522 -0.052827
H -6.970337 -2.360564 -0.173704
H 0.001505 -5.686271 1.204488
H -0.159139 -5.763063 -0.597947
H -1.627444 -5.594537 0.435394


