%chk=000040927.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000040927

0 1
 Cl  -4.323100     -0.6081000      -2.050200    
 O    1.869800       3.808300       1.638800    
 O    2.677400       1.706600       1.873200    
 N  -0.3781000       2.957500      0.3693000    
 C   0.8614000     -0.4651000      0.7066000    
 C   0.1440000      0.8015000      0.4456000    
 C   -1.113400      0.9318000     -0.2079000    
 C   0.5706000       2.063700      0.7885000    
 C    1.870500     -0.7100000     -0.4228000    
 C  -0.1211000      -1.593300       1.045900    
 C   -1.417800       2.294200     -0.2427000    
 C   -2.024200      1.8600000E-02 -0.7750000    
 C   -2.592400       2.791200     -0.8184000    
 C    3.207100     -0.7579000     -0.1076000    
 C  -0.9720000      -1.422700       2.111400    
 C    1.395500     -0.8707000      -1.701900    
 C  -0.1091000      -2.727500      0.2703000    
 C    1.771300       2.451400       1.461500    
 C   -3.203300      0.5013000      -1.354600    
 C   -3.481000       1.866600      -1.374800    
 C    4.124700     -0.9801000      -1.134400    
 C   -1.864900      -2.448800       2.420200    
 C    2.313000      -1.093000      -2.728900    
 C   -1.002200      -3.753600      0.5789000    
 C    3.677700      -1.147700      -2.444900    
 C   -1.880100      -3.614200       1.654000    
 H    1.438300     -0.3606000       1.636400    
 H  -0.3262000       3.959800      0.4900000    
 H   -1.836500      -1.046100     -0.8121000    
 H   -2.809300       3.853900     -0.8346000    
 H    3.568200     -0.6415000      0.9088000    
 H  -0.9617000     -0.5257000       2.722700    
 H   0.3445000     -0.8362000      -1.958700    
 H   0.5708000      -2.916100     -0.5484000    
 H   -4.399500       2.235100      -1.826800    
 H    5.187000      -1.025400     -0.9131000    
 H   -2.546500      -2.341400       3.258900    
 H    1.965100      -1.224300      -3.749400    
 H   -1.008700      -4.665300     -1.1500000E-02
 H    4.392000      -1.321700      -3.244300    
 H   -2.573700      -4.414100       1.895900    
 H    2.699600       4.052900       2.101400    


%chk=000040927-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000040927

0 1
Cl -4.433568 -0.429146 -2.286462
O 1.720495 3.930298 1.749900
O 2.590782 1.783390 2.052904
N -0.425700 3.082848 0.400577
C 0.848466 -0.453680 0.694978
C 0.068895 0.832951 0.458286
C -1.181275 1.025546 -0.246341
C 0.499589 2.120998 0.843100
C 1.826184 -0.725307 -0.461670
C -0.064693 -1.647115 1.050029
C -1.459893 2.443683 -0.266588
C -2.099541 0.128936 -0.867999
C -2.612118 2.978909 -0.889078
C 3.193338 -0.962226 -0.172749
C -0.996212 -1.504676 2.113112
C 1.401771 -0.758844 -1.815635
C 0.028614 -2.901118 0.399303
C 1.686543 2.521581 1.587138
C -3.228537 0.682312 -1.477113
C -3.502130 2.080599 -1.501749
C 4.116642 -1.233564 -1.208183
C -1.818230 -2.580567 2.507928
C 2.322030 -1.028612 -2.852398
C -0.794316 -3.982735 0.793174
C 3.683650 -1.269588 -2.553089
C -1.722300 -3.828227 1.846455
H 1.478827 -0.265905 1.586101
H -0.311865 4.080965 0.569631
H -1.936623 -0.951441 -0.852848
H -2.814173 4.054600 -0.900985
H 3.535503 -0.918498 0.867696
H -1.078005 -0.540284 2.629869
H 0.352801 -0.566325 -2.065807
H 0.748376 -3.038155 -0.414090
H -4.406819 2.444981 -1.996557
H 5.170359 -1.411120 -0.965011
H -2.531637 -2.448161 3.329297
H 1.977292 -1.049898 -3.892603
H -0.706464 -4.945313 0.276486
H 4.397247 -1.477738 -3.358323
H -2.360345 -4.665625 2.150240
H 2.540741 4.174570 2.254371


