%chk=000042532.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000042532

0 1
 Cl  -7.031400      0.9735000      -1.105600    
 F  -0.5925000      -2.827400       3.926700    
 N    2.194500      0.4322000     -0.9969000    
 N   0.9422000      9.7199999E-02 -0.4208000    
 N    2.703700       3.752200      0.6518000    
 N    2.900900      -2.301300      -1.626000    
 C    2.523700       1.863100     -0.8941000    
 C    2.348000     -3.9999999E-02  -2.382400    
 C   0.7587000     -0.6720000      0.7061000    
 C  -0.6177000     -0.7551000      0.9274000    
 C   -1.252400     -9.9999998E-03 -0.1054000    
 C  -0.2674000      0.5021000     -0.9182000    
 C    2.360200       2.338200      0.5465000    
 C    2.003600      -1.523700      -2.473600    
 C    1.696300      -1.293900       1.538300    
 C   -2.647200      0.2269000     -0.3460000    
 C   -1.083400      -1.494600       2.032600    
 C    1.210900      -2.022100       2.628300    
 C  -0.1572000      -2.122200       2.873500    
 C    2.468100       4.239200       2.011900    
 C    4.098600       3.973000      0.2675000    
 C    4.288900      -2.140500      -2.062000    
 C    2.524700      -3.715800      -1.639500    
 C   -3.376200     -0.6506000      -1.149400    
 C   -3.275500       1.335700      0.2222000    
 C   -4.731500     -0.4196000      -1.384400    
 C   -4.631000       1.566700     -1.2700000E-02
 C   -5.359100      0.6890000     -0.8160000    
 H    1.892700       2.462200      -1.564000    
 H    3.560700       1.967900      -1.227800    
 H    3.353700      0.1728000      -2.760700    
 H    1.668400      0.5079000      -3.049500    
 H  -0.3340000       1.122300      -1.803300    
 H    2.978200       1.731800       1.222700    
 H    1.318200       2.230500      0.8681000    
 H    2.096800      -1.837300      -3.522700    
 H   0.9566000      -1.711200      -2.208800    
 H    2.762900      -1.217600       1.355100    
 H   -2.146500      -1.582600       2.237900    
 H    1.912500      -2.517100       3.294800    
 H    2.675200       5.313100       2.078500    
 H    3.090600       3.720600       2.750200    
 H    1.417200       4.107500       2.292900    
 H    4.245800       3.880000     -0.8126000    
 H    4.789700       3.300000      0.7881000    
 H    4.399800       5.001500      0.5021000    
 H    4.684300      -1.148500      -1.823800    
 H    4.418400      -2.334100      -3.133000    
 H    4.939600      -2.837500      -1.519500    
 H    2.598300      -4.154000      -2.641400    
 H    1.497300      -3.843700      -1.280400    
 H    3.164800      -4.291600     -0.9617000    
 H   -2.902500      -1.519800      -1.599900    
 H   -2.722600       2.029700      0.8512000    
 H   -5.286400      -1.112000      -2.012300    
 H   -5.106700       2.434500      0.4368000    


%chk=000042532-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000042532

0 1
Cl -7.356827 1.361815 -0.744222
F -0.678919 -3.299053 3.575437
N 2.157815 0.444302 -1.031661
N 0.872469 0.101329 -0.521541
N 2.742106 3.751521 0.782940
N 3.315913 -2.345796 -1.754350
C 2.464738 1.893591 -0.863461
C 2.373520 -0.076196 -2.411780
C 0.672984 -0.824920 0.514445
C -0.740817 -0.869454 0.783436
C -1.390367 0.062575 -0.134459
C -0.367185 0.631959 -0.906158
C 2.462785 2.305998 0.622808
C 2.282785 -1.609966 -2.512998
C 1.622720 -1.599494 1.211925
C -2.826664 0.371805 -0.264206
C -1.203706 -1.708062 1.836404
C 1.146666 -2.438098 2.237287
C -0.242575 -2.456977 2.522799
C 2.230892 4.289664 2.061544
C 4.163784 4.096682 0.577124
C 4.683219 -2.147872 -2.270054
C 2.972455 -3.776217 -1.611481
C -3.825087 -0.612308 -0.013514
C -3.260415 1.668539 -0.664535
C -5.198668 -0.320712 -0.155053
C -4.627950 1.974473 -0.820543
C -5.582020 0.972017 -0.558802
H 1.760280 2.557640 -1.415901
H 3.468910 2.042180 -1.300473
H 3.374106 0.273976 -2.722868
H 1.639843 0.355100 -3.135564
H -0.443633 1.350729 -1.719971
H 3.187672 1.661281 1.179917
H 1.461018 2.103941 1.043632
H 2.309322 -1.865620 -3.606897
H 1.292902 -1.931098 -2.138548
H 2.677096 -1.558771 0.926280
H -2.254223 -1.765666 2.131513
H 1.821980 -3.071348 2.819617
H 2.378139 5.384495 2.086745
H 2.733363 3.854897 2.962369
H 1.148240 4.089436 2.143918
H 4.497690 3.789167 -0.429070
H 4.842903 3.617822 1.328215
H 4.291400 5.191487 0.648806
H 4.975096 -1.085730 -2.199919
H 4.806411 -2.474323 -3.335487
H 5.393912 -2.725511 -1.653005
H 2.913127 -4.320783 -2.588282
H 1.997965 -3.873536 -1.101029
H 3.733696 -4.279837 -0.989233
H -3.528460 -1.630472 0.256901
H -2.519144 2.457909 -0.832947
H -5.953809 -1.088984 0.035339
H -4.945953 2.975975 -1.124587


