%chk=000045594.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000045594

0 1
 Cl  -7.782000      0.4730000     -0.7151000    
 N    4.471500      -1.851000      0.1404000    
 N   -1.171500     -0.3371000     -0.1532000    
 C    1.172900     -0.6820000     -0.9012000    
 C    2.575100     -0.8791000     -0.4810000    
 C    3.549100      0.1375000     -0.2743000    
 C   0.2100000     -0.5009000      0.2865000    
 C    4.729700     -0.4989000      0.1148000    
 C    3.172200      -2.090500     -0.2182000    
 C   -2.063100     -0.1783000      0.9867000    
 C    3.539500       1.542500     -0.3812000    
 C    5.905900      0.2022000      0.4034000    
 C   -3.497300     -1.4900000E-02  0.5584000    
 C    4.708700       2.256900     -9.5600002E-02
 C    5.872600       1.595000      0.2904000    
 C   -3.997600       1.256800      0.3166000    
 C   -4.298900      -1.138400      0.4128000    
 C   -5.326800       1.408100     -7.8900002E-02
 C   -5.628000     -0.9871000      1.7300000E-02
 C   -6.142000      0.2861000     -0.2285000    
 H    1.102500      0.1887000      -1.565700    
 H   0.8483000      -1.543800      -1.500000    
 H   0.5242000      0.3721000      0.8732000    
 H   0.2878000      -1.377900      0.9419000    
 H    2.790600      -3.101500     -0.2529000    
 H   -1.235800      0.4812000     -0.7587000    
 H    5.144600      -2.563000      0.3883000    
 H   -1.990000      -1.048300       1.652400    
 H   -1.768300      0.6912000       1.589300    
 H    2.640600       2.074500     -0.6795000    
 H    6.812500     -0.3122000      0.7041000    
 H    4.707100       3.340800     -0.1760000    
 H    6.769400       2.169700      0.5076000    
 H   -3.370800       2.137000      0.4287000    
 H   -3.908400      -2.134700      0.6002000    
 H   -5.713600       2.406300     -0.2672000    
 H   -6.251500      -1.870300     -9.5399998E-02


%chk=000045594-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000045594

0 1
Cl -7.976554 0.048435 -0.737276
N 4.602402 -1.985761 0.278960
N -1.134353 -0.218462 -0.046497
C 1.137727 -0.959369 -0.740076
C 2.592985 -1.093506 -0.364938
C 3.571160 -0.020573 -0.261302
C 0.275463 -0.331648 0.384179
C 4.822078 -0.610076 0.143966
C 3.262151 -2.270500 -0.029730
C -2.052820 0.323320 0.976253
C 3.515124 1.382247 -0.481502
C 5.994028 0.155182 0.335564
C -3.509407 0.269248 0.527659
C 4.679953 2.151087 -0.294318
C 5.906102 1.544283 0.112116
C -4.426278 1.269534 0.935919
C -3.978421 -0.796632 -0.281356
C -5.788383 1.209770 0.561710
C -5.334273 -0.871571 -0.670783
C -6.219223 0.134954 -0.238325
H 1.041300 -0.331766 -1.651497
H 0.706149 -1.945816 -0.990357
H 0.720381 0.648157 0.687444
H 0.314018 -0.985176 1.277152
H 2.882203 -3.290215 0.007345
H -1.220905 0.291553 -0.937499
H 5.304087 -2.672093 0.545886
H -1.926329 -0.299401 1.886696
H -1.805099 1.369711 1.285651
H 2.580550 1.860877 -0.796286
H 6.939129 -0.305727 0.644524
H 4.650908 3.233529 -0.462053
H 6.795131 2.169611 0.251107
H -4.079995 2.107691 1.552875
H -3.263535 -1.559894 -0.604844
H -6.493602 1.983335 0.879012
H -5.694651 -1.694638 -1.294978


