%chk=000152786.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000152786

0 1
 Cl   3.869000      -5.139900      0.1548000    
 O   0.8525000       4.637100      3.5999999E-03
 N   -4.537700     -0.7557000     -9.9500000E-02
 N  -0.3930000      2.4999999E-03 -0.8864000    
 N    3.541000     -8.7300003E-02  0.5200000    
 N   0.8975000       2.327500     -0.2003000    
 C   -4.984300      -1.846400      0.7666000    
 C   -5.447900      0.3530000      0.1863000    
 C   -6.499800      -1.776400      0.6500000    
 C   -6.804300     -0.3318000      0.2652000    
 C   -3.144000     -0.4025000      0.1255000    
 C   -2.719200      0.7118000     -0.8329000    
 C   -1.256100       1.110500     -0.6528000    
 C   0.9462000     -3.6800001E-02 -0.4087000    
 C    1.613300      -1.261900     -0.2858000    
 C    1.560600       1.160700     -7.3200002E-02
 C    2.932100      -1.240200      0.1909000    
 C    2.878900       1.080100      0.3934000    
 C   0.9988000      -2.480700     -0.6234000    
 C    3.605700      -2.452600      0.3173000    
 C    3.500200       2.276500      0.7313000    
 C    1.692100      -3.679900     -0.4886000    
 C    2.998700      -3.665400     -1.7100001E-02
 C    1.542800       3.462600      0.1402000    
 C    2.837500       3.491200      0.6089000    
 C  -0.4809000       4.544000     -0.4853000    
 H   -4.685700      -1.685200       1.810500    
 H   -4.599500      -2.817700      0.4399000    
 H   -5.458300       1.114700     -0.5991000    
 H   -5.219300      0.8350000       1.145600    
 H   -6.987900      -2.057300       1.588700    
 H   -6.862000      -2.452800     -0.1331000    
 H   -7.311600     -0.3067000     -0.7065000    
 H   -7.457200      0.1537000      0.9975000    
 H   -2.972100     -8.7700002E-02   1.163100    
 H   -2.526600      -1.291700     -4.8000000E-02
 H   -2.883600      0.3872000      -1.869000    
 H   -3.319200       1.615900     -0.6794000    
 H   -1.177300       1.487400      0.3740000    
 H   -1.065500       1.902200      -1.382800    
 H  -0.7247000     -0.7645000      -1.456800    
 H  -2.3100000E-02  -2.543200     -0.9844000    
 H    4.630800      -2.450400      0.6863000    
 H    4.524300       2.271600       1.099300    
 H    1.201500      -4.613100     -0.7515000    
 H    3.328200       4.420700      0.8742000    
 H  -0.4976000       4.139400      -1.501900    
 H  -0.8910000       5.557800     -0.5266000    
 H   -1.110700       3.960600      0.1932000    


%chk=000152786-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000152786

0 1
Cl 3.880601 -5.300711 -0.216709
O 1.261427 4.809497 0.220202
N -4.628261 -0.781467 0.091770
N -0.452819 0.059417 -0.688039
N 3.730265 -0.153761 0.308887
N 1.066957 2.469599 -0.056997
C -5.088723 -1.614977 1.234976
C -5.799400 0.068991 -0.250969
C -6.527874 -2.028173 0.835178
C -7.004361 -0.902822 -0.146573
C -3.369622 -0.056546 0.344274
C -2.835151 0.653667 -0.919080
C -1.400613 1.193491 -0.750233
C 0.882620 0.032969 -0.350709
C 1.572043 -1.246648 -0.310921
C 1.657326 1.205694 -0.035376
C 2.990410 -1.271880 0.011680
C 3.065175 1.039963 0.287125
C 0.917235 -2.497715 -0.570026
C 3.685414 -2.531925 0.032741
C 3.818521 2.233596 0.597960
C 1.603968 -3.712063 -0.542141
C 2.998639 -3.703054 -0.242035
C 1.814450 3.530657 0.234396
C 3.212524 3.476953 0.577656
C -0.166834 4.905710 -0.128637
H -5.107581 -1.026435 2.188782
H -4.413093 -2.476443 1.383332
H -5.691983 0.506895 -1.258597
H -5.915184 0.912416 0.479628
H -7.180750 -2.118240 1.720615
H -6.520907 -3.005040 0.322689
H -7.240427 -1.331345 -1.135309
H -7.907202 -0.382069 0.216982
H -3.481626 0.701157 1.166414
H -2.621212 -0.793247 0.697562
H -2.884252 -0.053920 -1.772764
H -3.491100 1.504997 -1.180524
H -1.311072 1.797267 0.167551
H -1.137496 1.862893 -1.591021
H -0.849407 -0.824621 -1.008774
H -0.157082 -2.545356 -0.785431
H 4.751097 -2.514971 0.272712
H 4.876345 2.104365 0.844276
H 1.089553 -4.656630 -0.738258
H 3.744928 4.403657 0.804764
H -0.352128 4.488143 -1.133734
H -0.386982 5.982958 -0.103168
H -0.784756 4.361008 0.607070


