%chk=000085393.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000085393

0 1
 Cl   6.507800       1.670700     -9.6500002E-02
 O   -5.377900       1.477500     -0.5331000    
 O   0.9769000      -1.976300     -0.9875000    
 N  -0.8669000      -1.413900      0.9555000    
 N   0.3582000     -0.8106000      0.9170000    
 C   -2.002600     -0.6856000      0.5810000    
 C    2.531800     -0.4587000     -0.1016000    
 C   -3.209900      -1.343800      0.3183000    
 C   -1.943200      0.7083000      0.4647000    
 C   -4.273800      0.7699000     -0.1688000    
 C    1.249600      -1.145200     -0.1027000    
 C   -4.341400     -0.6187000     -5.5399999E-02
 C   -3.074900       1.433400      9.1200002E-02
 C    3.651000      -1.070100     -0.6668000    
 C    2.642300      0.8110000      0.4652000    
 C    4.880600     -0.4116000     -0.6650000    
 C    3.872000       1.469400      0.4668000    
 C    4.991200      0.8581000     -9.8300003E-02
 C   -6.570800      0.7361000     -0.7840000    
 H   -3.275700      -2.426000      0.4029000    
 H   -1.031200       1.264200      0.6650000    
 H  -0.8954000      -2.424100       1.007900    
 H   -5.239700      -1.196900     -0.2426000    
 H   -3.017100       2.515200      6.0000001E-03
 H   0.5645000     -0.1962000       1.697100    
 H    3.586400      -2.060700      -1.109300    
 H    1.789800       1.331300      0.8920000    
 H    5.744600     -0.9004000      -1.108000    
 H    3.942500       2.460900      0.9069000    
 H   -6.920800      0.2201000      0.1165000    
 H   -7.347000       1.456900      -1.061200    
 H   -6.450000      5.4400001E-02  -1.632700    


%chk=000085393-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000085393

0 1
Cl 6.823457 1.594135 0.016102
O -5.566984 1.470050 -0.547408
O 1.073136 -2.043381 -0.931846
N -0.874596 -1.381964 0.895156
N 0.368601 -0.721064 0.839793
C -2.044200 -0.663990 0.483269
C 2.651005 -0.415972 -0.027952
C -3.264921 -1.372868 0.365792
C -2.035588 0.736862 0.256208
C -4.441610 0.695847 -0.203863
C 1.324456 -1.115589 -0.099546
C -4.457838 -0.704115 0.016647
C -3.224801 1.408437 -0.082041
C 3.758010 -1.047591 -0.649895
C 2.831627 0.850030 0.589454
C 5.031677 -0.444319 -0.640696
C 4.100638 1.466716 0.606843
C 5.183976 0.804324 -0.004516
C -6.840728 0.767635 -0.698196
H -3.286934 -2.453846 0.549085
H -1.096346 1.294552 0.319958
H -0.789087 -2.337417 0.524095
H -5.382386 -1.282060 -0.074833
H -3.228922 2.487260 -0.265779
H 0.640386 -0.221487 1.688930
H 3.596904 -2.010437 -1.144918
H 1.984114 1.388967 1.028229
H 5.887060 -0.930784 -1.117608
H 4.242820 2.445074 1.074124
H -7.150239 0.280820 0.248054
H -7.569748 1.546069 -0.967925
H -6.792042 0.008707 -1.504217


