%chk=000053478.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000053478

0 1
 Cl   3.273700      0.5457000      -2.909400    
 O   0.4645000     -0.1549000      -1.793400    
 O   -3.998000       1.141900      0.1615000    
 O   -5.216900      -2.203000       1.021600    
 O    6.185200      -2.042700       1.979900    
 O    7.037800      -1.549000      1.8200001E-02
 N   -1.833200      0.4756000     -0.4620000    
 N   -5.124600      -1.025400     -0.9780000    
 N    6.071400      -1.583300      0.8178000    
 N   -7.910600      -1.698000       1.191600    
 C   0.3562000       1.474300     -0.1187000    
 C   -1.018700       1.512300      5.2600000E-02
 C    1.017300      0.3842000     -0.8254000    
 C    2.362200     -0.1251000     -0.4266000    
 C    1.139100       2.506500      0.3983000    
 C   -1.630600       2.557100      0.7283000    
 C   -3.686500     -0.9072000      -1.064000    
 C   -3.218100      0.3622000     -0.3759000    
 C    3.419400     -8.4600002E-02  -1.308000    
 C    2.482400     -0.6290000      0.8515000    
 C   0.5370000       3.564000       1.080400    
 C  -0.8477000       3.589400       1.245200    
 C    4.810000      -1.087300      0.3945000    
 C    4.658900     -0.5717000     -0.8929000    
 C    3.721600      -1.115900       1.266500    
 C   -5.774200      -1.668400      6.5600000E-02
 C   -7.277800      -1.668000     -0.1193000    
 H    2.218500       2.522300      0.2740000    
 H   -1.344100     -0.2729000     -0.9459000    
 H   -2.691100       2.656400      0.9013000    
 H   -3.415600     -0.8714000      -2.123600    
 H   -3.215600      -1.775200     -0.5915000    
 H    1.640600     -0.6623000       1.536900    
 H    1.146100       4.369500       1.480300    
 H   -1.315000       4.414000       1.775900    
 H    5.495600     -0.5406000      -1.587700    
 H    3.801900      -1.511500       2.275800    
 H   -5.673500     -0.6085000      -1.724100    
 H   -7.605400     -0.7751000     -0.6604000    
 H   -7.561100      -2.551100     -0.7000000    
 H   -7.603200      -2.521800       1.706900    
 H   -7.616700     -0.8889000       1.737200    


%chk=000053478-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000053478

0 1
Cl 2.531923 0.657401 -2.427169
O 0.177527 -1.073914 0.302660
O -4.001323 1.591713 -0.094980
O -5.750178 -2.997833 -0.142691
O 7.101265 -1.808190 1.317591
O 7.300315 -1.005261 -0.809501
N -1.903429 0.525091 0.105450
N -5.360299 -0.713053 -0.200070
N 6.615309 -1.274706 0.249241
N -8.603350 -2.587813 -0.062955
C 0.406505 1.341983 0.251166
C -1.013699 1.616720 0.173114
C 0.930857 -0.035225 0.244512
C 2.426066 -0.291102 0.217419
C 1.311967 2.439720 0.349548
C -1.463084 2.965875 0.167839
C -3.915653 -0.854864 -0.068912
C -3.287198 0.545538 -0.021532
C 3.246855 -0.044473 -0.910047
C 3.015909 -0.909604 1.351387
C 0.857519 3.765671 0.357885
C -0.534483 4.018739 0.258804
C 5.163363 -0.944664 0.240569
C 4.615108 -0.363161 -0.920570
C 4.385225 -1.231466 1.381685
C -6.193266 -1.810699 -0.240332
C -7.699626 -1.500933 -0.452920
H 2.384313 2.235276 0.428360
H -1.419170 -0.397385 0.169189
H -2.533813 3.162250 0.095961
H -3.495546 -1.435443 -0.915352
H -3.658156 -1.424463 0.847156
H 2.380969 -1.138681 2.212596
H 1.567854 4.593896 0.437292
H -0.901689 5.050906 0.257685
H 5.247455 -0.178961 -1.792372
H 4.850806 -1.697049 2.253394
H -5.709105 0.251282 -0.249853
H -7.977176 -0.578423 0.091744
H -7.845313 -1.284120 -1.529915
H -8.350783 -3.471833 -0.521911
H -8.639568 -2.726141 0.953835


