%chk=000044575.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000044575

0 1
 Cl   5.627000      -1.132900      8.9900002E-02
 O   0.6160000      -2.530000     -0.8489000    
 O   0.3178000       1.383700     -0.1344000    
 N   -4.159700      0.1634000      0.2570000    
 N  -0.6592000     -0.9681000      0.2965000    
 N    5.074600       1.856900      0.2164000    
 C   -1.897800      -1.713600      0.2746000    
 C   -2.705100      -1.405500     -0.9886000    
 C   -2.739100      -1.423100       1.519600    
 C   -3.333500     -9.1000004E-03 -0.9454000    
 C   -3.366800     -2.6200000E-02   1.479000    
 C   -4.794200       1.481300      0.2575000    
 C   -5.660700       1.674100     -0.9756000    
 C   0.5081000      -1.448800     -0.2762000    
 C    1.702100     -0.5744000     -0.1457000    
 C    1.545800      0.7953000     -8.1799999E-02
 C    2.944500      -1.174700     -9.3800001E-02
 C    2.679200       1.599200      3.9099999E-02
 C    4.077800     -0.3707000      2.7100001E-02
 C    3.945300       1.016200      9.3400002E-02
 C   0.2780000       2.807200     -5.9599999E-02
 H   -1.639600      -2.779800      0.2711000    
 H   -3.504200      -2.151600      -1.091700    
 H   -2.073800      -1.493300      -1.881200    
 H   -2.128600      -1.522200       2.425300    
 H   -3.540200      -2.170500       1.592500    
 H   -2.549600      0.7574000     -0.9992000    
 H   -3.932400      7.0799999E-02  -1.858100    
 H   -4.015300      7.6200001E-02   2.358000    
 H   -2.587800      0.7420000       1.565500    
 H   -5.440800       1.567200       1.139500    
 H   -4.054200       2.289400      0.3167000    
 H  -0.6627000     -6.1799999E-02  0.7524000    
 H   -5.070800       1.868400      -1.876600    
 H   -6.313400      0.8126000      -1.153600    
 H   -6.307000       2.547600     -0.8333000    
 H    3.048700      -2.255700     -0.1398000    
 H    2.639000       2.682200      9.5200002E-02
 H    5.999800       1.450200      0.2564000    
 H    4.960700       2.860600      0.2622000    
 H   0.6573000       3.172700      0.9006000    
 H  -0.7757000       3.100800     -0.1150000    
 H   0.7810000       3.271800     -0.9145000    


%chk=000044575-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000044575

0 1
Cl 5.510250 -1.087543 -1.406416
O 0.502527 -2.530799 -0.491372
O 0.571597 1.492051 0.932826
N -4.232833 0.170332 -0.036679
N -0.721041 -0.830354 0.511768
N 5.312155 1.754596 -0.335881
C -1.956940 -1.636110 0.586399
C -2.705263 -1.665874 -0.773212
C -2.894727 -1.065556 1.673770
C -3.319082 -0.295454 -1.115174
C -3.513255 0.285608 1.254531
C -4.940390 1.431657 -0.376678
C -5.946870 1.278530 -1.532096
C 0.439040 -1.339070 -0.031212
C 1.650578 -0.438995 -0.059490
C 1.742818 0.914310 0.392664
C 2.826509 -1.015018 -0.604352
C 2.947734 1.642082 0.303328
C 4.016299 -0.296386 -0.693033
C 4.122227 1.050955 -0.244147
C 0.614368 2.879856 1.397209
H -1.652554 -2.668217 0.839798
H -3.514042 -2.418907 -0.712419
H -2.003962 -1.982191 -1.565547
H -2.349904 -0.951627 2.630543
H -3.716708 -1.787069 1.833841
H -2.497524 0.449300 -1.290668
H -3.891764 -0.378168 -2.054847
H -4.233175 0.615878 2.027203
H -2.711696 1.076580 1.206358
H -5.488687 1.751562 0.531042
H -4.214519 2.253640 -0.619713
H -0.704755 0.138265 0.849488
H -5.450090 1.074067 -2.496985
H -6.644340 0.449259 -1.319804
H -6.532360 2.208725 -1.651791
H 2.747495 -2.050758 -0.950822
H 3.004922 2.676631 0.654254
H 6.133756 1.302069 -0.731004
H 5.380985 2.714700 -0.013567
H 1.339838 3.001084 2.223790
H -0.401681 3.092343 1.761608
H 0.865562 3.569216 0.568989


