%chk=000086252.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000086252

0 1
 Cl   3.399300      -2.487400     -0.3181000    
 O   -4.725200     -0.6419000     -0.7308000    
 N   -1.190200     -0.2208000      0.2589000    
 N    1.651900     -1.3900000E-02  5.9300002E-02
 N   -4.952400       1.269000      0.4962000    
 N   -6.679200     -0.3852000      0.4232000    
 C  -0.5446000     -9.1700003E-02  -1.053200    
 C  -0.3247000     -0.9821000       1.168500    
 C   -2.493800     -0.8704000      0.1278000    
 C   0.7964000      0.6373000     -0.9374000    
 C    1.022700     -0.2819000       1.358600    
 C   -3.430800     -5.1199999E-02 -0.7481000    
 C   -3.672200       1.348000     -0.2181000    
 C    3.035200      0.1946000      2.9100001E-02
 C   -5.465600      0.1443000      0.1038000    
 C    3.955800     -0.8619000     -0.1396000    
 C    3.550100       1.499800      0.1694000    
 C    5.329700     -0.6221000     -0.1666000    
 C    4.924000       1.739300      0.1426000    
 C    5.813800      0.6784000     -2.5400000E-02
 H  -0.3893000      -1.078500      -1.509800    
 H   -1.141000      0.5045000      -1.749500    
 H  -0.8021000      -1.076300       2.151300    
 H  -0.1593000      -1.998600      0.7863000    
 H   -2.403500      -1.885100     -0.2836000    
 H   -2.948500     -0.9944000       1.120000    
 H   0.6307000       1.685000     -0.6558000    
 H    1.286200      0.6307000      -1.919100    
 H    1.665900     -0.9210000       1.976000    
 H   0.8853000      0.6638000       1.898600    
 H   -3.107600     -2.9500000E-02  -1.792500    
 H   -2.883800       1.726900      0.4381000    
 H   -3.779600       2.059100      -1.045800    
 H    2.875800       2.342400      0.3073000    
 H    6.036500      -1.437700     -0.2965000    
 H    5.301200       2.751700      0.2538000    
 H    6.883500      0.8651000     -4.6000000E-02
 H   -7.321500      0.1017000       1.038800    
 H   -6.975800      -1.282800      5.6100000E-02


%chk=000086252-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000086252

0 1
Cl 3.463691 -2.420199 1.107062
O -4.836605 -0.335798 -0.887836
N -1.160269 -0.227494 0.013154
N 1.724403 -0.053834 -0.040822
N -5.214393 0.860189 1.102101
N -6.895750 -0.613207 0.194513
C -0.421896 -0.029091 -1.257888
C -0.332390 -1.009991 0.967162
C -2.518031 -0.784734 -0.186783
C 0.907583 0.706966 -1.008958
C 0.992000 -0.279645 1.234409
C -3.520124 0.321450 -0.573388
C -3.867758 1.290245 0.606420
C 3.122257 0.173385 -0.006808
C -5.672469 0.010347 0.219315
C 4.046040 -0.780914 0.519788
C 3.700130 1.362680 -0.550016
C 5.433431 -0.560317 0.550482
C 5.091882 1.585331 -0.550788
C 5.969136 0.632813 0.013019
H -0.203742 -1.007374 -1.756074
H -1.036731 0.574231 -1.950492
H -0.888812 -1.112168 1.916814
H -0.105237 -2.033882 0.579939
H -2.542165 -1.588301 -0.961493
H -2.858883 -1.235790 0.764286
H 0.680982 1.735943 -0.641560
H 1.458424 0.787289 -1.962759
H 1.612313 -0.875399 1.920145
H 0.771887 0.699951 1.717590
H -3.211723 0.847887 -1.491723
H -3.108296 1.214969 1.403894
H -3.910987 2.345419 0.276689
H 3.035603 2.131605 -0.955940
H 6.089611 -1.331546 0.965197
H 5.487938 2.513761 -0.976776
H 7.050591 0.800013 0.027169
H -7.577658 -0.385784 0.910757
H -7.100684 -1.301808 -0.522003


