%chk=000043950.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000043950

0 1
 Cl  -1.920500       4.861200      0.7425000    
 O   -4.253900     -0.6477000      -2.225800    
 O   -5.387800      -1.903800     -2.2299999E-02
 N   0.7807000     -0.6164000       1.306300    
 N    2.479600       1.144200     -0.6734000    
 C  -1.2900000E-02 -3.0900000E-02  0.1910000    
 C   3.8100000E-02 -0.5742000       2.573600    
 C   -1.451400     -0.5404000      0.1424000    
 C   -1.215300      -1.443400       2.489400    
 C   -2.029100      -1.177800       1.253200    
 C    2.115300     -2.0600000E-02   1.493700    
 C   0.1494000       1.488500      7.6300003E-02
 C   -2.215600     -0.3756000      -1.026200    
 C    2.807500      0.1870000      0.1488000    
 C    1.399800       1.995500     -0.3565000    
 C   -3.352400      -1.635600       1.181900    
 C  -0.8628000       2.393000      0.4334000    
 C   -3.534200     -0.8260000      -1.083200    
 C   -4.102700      -1.454000      2.1000000E-02
 C    3.915200     -0.7331000     -0.2323000    
 C    1.581000       3.377800     -0.4857000    
 C  -0.6614000       3.768600      0.3123000    
 C   0.5544000       4.259900     -0.1542000    
 C    3.914200      -2.044700      0.2326000    
 C    4.942900     -0.2750000      -1.050900    
 C    4.951100      -2.906500     -0.1244000    
 C    5.979900      -1.137000      -1.407800    
 C   -5.001700      0.5615000      -2.339000    
 C   -5.591400      -3.241900     -0.4721000    
 C    5.984000      -2.452700     -0.9446000    
 H   0.4180000     -0.4586000     -0.7275000    
 H  -0.2325000      0.4573000       2.835000    
 H   0.6576000     -0.9590000       3.393700    
 H   -1.826500      -1.267200       3.382700    
 H  -0.9268000      -2.502400       2.486400    
 H    2.721400     -0.6581000       2.145800    
 H    2.062300      0.9500000       2.005600    
 H   -1.778100      0.1100000      -1.895900    
 H   -3.796800      -2.141600       2.036200    
 H   -1.815400       2.030700      0.8119000    
 H    2.531700       3.774900     -0.8334000    
 H   0.7214000       5.329200     -0.2554000    
 H    3.113600      -2.438200      0.8513000    
 H    4.964500      0.7476000      -1.417300    
 H    4.951700      -3.932800      0.2312000    
 H    6.785100     -0.7835000      -2.045300    
 H   -5.747100      0.6295000      -1.540400    
 H   -4.335000       1.429100      -2.305800    
 H   -5.520100      0.5550000      -3.301700    
 H   -5.090100      -3.950900      0.1944000    
 H   -5.224600      -3.364400      -1.496100    
 H   -6.665100      -3.448200     -0.4583000    
 H    6.790800      -3.124100      -1.223500    


%chk=000043950-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000043950

0 1
Cl -2.062803 4.879317 0.596576
O -4.159943 -0.605231 -2.259996
O -5.397044 -1.927314 0.049398
N 0.821448 -0.611123 1.432563
N 2.585394 1.183845 -0.577079
C 0.073983 -0.057752 0.252667
C 0.056316 -0.506815 2.701651
C -1.370251 -0.554667 0.229427
C -1.180781 -1.414259 2.629334
C -1.972605 -1.182283 1.351196
C 2.173230 0.001393 1.566517
C 0.210299 1.478529 0.137727
C -2.128093 -0.373427 -0.953422
C 2.882392 0.170405 0.218401
C 1.474887 2.016021 -0.282266
C -3.311055 -1.636067 1.249915
C -0.858535 2.366117 0.397442
C -3.463097 -0.806005 -1.043894
C -4.057628 -1.472590 0.068212
C 3.970903 -0.758334 -0.183899
C 1.613051 3.414439 -0.490658
C -0.670598 3.750796 0.237334
C 0.548923 4.294822 -0.214526
C 4.104771 -2.040728 0.416727
C 4.883740 -0.381064 -1.209594
C 5.129682 -2.919967 0.005596
C 5.911246 -1.255984 -1.610467
C -5.317056 0.315257 -2.152964
C -5.681436 -2.977840 -0.956907
C 6.040032 -2.529822 -1.003285
H 0.580691 -0.479714 -0.638951
H -0.244330 0.547699 2.920095
H 0.717681 -0.835570 3.524557
H -1.823342 -1.248998 3.515298
H -0.845123 -2.469493 2.662465
H 2.770196 -0.619841 2.255420
H 2.108182 1.024695 2.016078
H -1.692476 0.127342 -1.825226
H -3.794441 -2.139078 2.095137
H -1.832426 1.972914 0.703038
H 2.571176 3.794960 -0.857652
H 0.660418 5.373734 -0.355010
H 3.387157 -2.366334 1.177377
H 4.761537 0.602409 -1.673362
H 5.215458 -3.909819 0.467309
H 6.613148 -0.950520 -2.394401
H -6.044509 -0.049516 -1.405045
H -4.971226 1.329394 -1.876447
H -5.769983 0.334592 -3.155906
H -5.108856 -3.894456 -0.719057
H -5.426935 -2.631350 -1.974484
H -6.760574 -3.177490 -0.872952
H 6.839203 -3.211027 -1.316410


