%chk=000044669.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000044669

0 1
 Cl  -4.313300       2.080000     -0.7160000    
 O   -2.233000       2.402900       1.371500    
 O    3.674900     -0.1858000       1.241100    
 N   -1.918700      -2.426900      -1.297300    
 N    2.361900      -1.272100     -0.3332000    
 C  -0.3230000      -2.006200      0.4111000    
 C   0.8357000      -2.266500       1.305200    
 C   -1.108200     -0.9315000      0.3545000    
 C  -0.7518000      -3.024100     -0.6012000    
 C    2.096900      -2.457800      0.4714000    
 C   -2.056900      -1.272500     -0.7170000    
 C   -1.177200      0.3120000       1.052300    
 C   -3.088400     -0.2560000      -1.032800    
 C   -2.136400       1.190800      0.7179000    
 C    3.257800      0.8735000     -0.8956000    
 C   -3.102500      0.8975000     -0.3396000    
 C    3.138600     -0.2327000      0.1373000    
 C    4.111600       2.039200     -0.4053000    
 C    4.189600       3.148000      -1.441800    
 C   -1.457700       3.388200      0.7175000    
 H   0.6461000      -3.167400       1.899800    
 H   0.9785000      -1.442400       2.013500    
 H   2.9800000E-02  -3.228400      -1.338700    
 H   -1.052300      -3.960100     -0.1194000    
 H    2.951100      -2.639100       1.133200    
 H    2.022200      -3.311500     -0.2094000    
 H  -0.4602000      0.5277000       1.836000    
 H    1.957300      -1.222300      -1.263800    
 H   -3.799800     -0.4833000      -1.818400    
 H    3.693200      0.4483000      -1.807800    
 H    2.247200       1.225700      -1.136200    
 H    5.124000       1.688500     -0.1717000    
 H    3.694100       2.443900      0.5245000    
 H    4.634500       2.783600      -2.373300    
 H    3.194600       3.544400      -1.667900    
 H    4.806800       3.971800      -1.070100    
 H   -1.620000       4.342000       1.228600    
 H   -1.744900       3.517800     -0.3314000    
 H  -0.3893000       3.152900      0.7818000    


%chk=000044669-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000044669

0 1
Cl -3.886287 2.416998 -0.484764
O -1.150659 2.599860 0.874467
O 4.076661 -0.620200 0.754266
N -2.480858 -2.645464 -0.582128
N 2.319362 -1.265161 -0.625510
C -0.325824 -2.316267 0.524275
C 1.034060 -2.614488 1.085870
C -0.960987 -1.086675 0.373662
C -1.273673 -3.346089 -0.069200
C 2.162455 -2.582152 -0.000725
C -2.259719 -1.351511 -0.301392
C -0.595487 0.261942 0.732453
C -3.155276 -0.246831 -0.580694
C -1.465551 1.301144 0.442068
C 3.293226 0.988526 -0.933004
C -2.751385 1.018944 -0.213301
C 3.271465 -0.350530 -0.189733
C 3.318031 2.191837 0.041727
C 3.512611 3.534802 -0.691406
C -0.716022 3.550817 -0.172832
H 1.051127 -3.619941 1.549838
H 1.308215 -1.885658 1.870473
H -0.813223 -3.932406 -0.891817
H -1.590996 -4.091600 0.690015
H 3.123592 -2.823600 0.484919
H 1.957311 -3.336238 -0.782957
H 0.343729 0.489258 1.246746
H 1.644333 -0.975082 -1.334632
H -4.123978 -0.435949 -1.049814
H 4.215281 1.012092 -1.547719
H 2.436751 1.073841 -1.631449
H 4.134087 2.027824 0.768753
H 2.376278 2.214393 0.626105
H 4.469442 3.548042 -1.246505
H 2.700858 3.722386 -1.420908
H 3.525714 4.378404 0.022226
H -0.532079 4.497373 0.356397
H -1.499509 3.695352 -0.938510
H 0.219721 3.194106 -0.645962


