%chk=000178292.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000178292

0 1
 Cl  -5.117200      -2.436500      0.6474000    
 O  -0.3504000       3.638000      0.5172000    
 N   9.0499997E-02   1.616300     -0.5328000    
 N    1.860800       3.004500      0.2837000    
 N   -3.549800     -0.4978000       2.393300    
 C    3.259100      -3.069300     -5.6400001E-02
 C    2.427900      -1.837300     -0.1821000    
 C   0.8974000      0.4239000     -0.4118000    
 C   -1.135200       1.600600      -1.338300    
 C    1.684500      -1.613000      -1.340900    
 C    2.392100     -0.9106000      0.8598000    
 C   0.9055000     -0.4618000      -1.457700    
 C    1.613000      0.2405000      0.7429000    
 C   -2.128000      0.5949000     -0.8312000    
 C    2.802700      -3.971400       1.105700    
 C    4.760500      -2.754800      8.4899999E-02
 C   0.4758000       2.806000      0.1233000    
 C   -2.383000      0.5076000      0.5322000    
 C   -2.782000     -0.2389000      -1.730600    
 C   -3.305700     -0.4266000       1.003100    
 C   -3.704600      -1.173100      -1.259700    
 C   -3.966400      -1.266900      0.1071000    
 C    2.412200       3.768800       1.394000    
 C    2.840200       2.456900     -0.6533000    
 H    3.151200      -3.664900     -0.9733000    
 H  -0.8648000       1.435200      -2.387200    
 H   -1.607500       2.590500      -1.309600    
 H    1.704900      -2.322500      -2.163900    
 H    2.951100      -1.072900       1.777200    
 H   0.3618000     -0.3119000      -2.382800    
 H    1.554300      0.8989000       1.603000    
 H    3.369900      -4.908600       1.109500    
 H    2.947500      -3.490600       2.079100    
 H    1.740400      -4.221700       1.009700    
 H    5.107100      -2.131200     -0.7467000    
 H    4.981600      -2.223800       1.017100    
 H    5.348400      -3.679000      8.0100000E-02
 H   -1.882600       1.167900       1.236100    
 H   -2.587000     -0.1746000      -2.797400    
 H   -4.211100      -1.820400      -1.971200    
 H    2.911400       4.657800      0.9986000    
 H    3.132500       3.146800       1.932700    
 H    1.618800       4.075300       2.080700    
 H    3.481100       3.289400     -0.9684000    
 H    2.392300       2.068200      -1.569600    
 H    3.490100       1.728500     -0.1633000    
 H   -3.060100      0.1184000       3.028200    
 H   -4.215100      -1.170100       2.751700    


%chk=000178292-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000178292

0 1
Cl -5.055518 -2.286457 1.460479
O -0.570984 3.369770 0.559711
N 0.256138 1.580821 -0.728272
N 1.741508 3.090622 0.399870
N -4.090888 0.438586 2.445283
C 3.434770 -3.306403 -0.351737
C 2.615935 -2.016655 -0.446270
C 1.064738 0.392482 -0.631642
C -1.076998 1.463382 -1.402565
C 2.106615 -1.563367 -1.688352
C 2.328224 -1.235359 0.703719
C 1.348648 -0.376629 -1.787380
C 1.559024 -0.058162 0.620518
C -2.055738 0.526676 -0.699661
C 2.731173 -4.365501 0.538877
C 4.877802 -3.034814 0.152330
C 0.429935 2.709688 0.115556
C -2.616404 0.906258 0.539401
C -2.410639 -0.714297 -1.286571
C -3.537254 0.065228 1.227212
C -3.323570 -1.568332 -0.625738
C -3.865894 -1.172942 0.604620
C 1.962768 4.094524 1.452650
C 2.918738 2.729346 -0.405180
H 3.511698 -3.727554 -1.374802
H -0.910582 1.122583 -2.440034
H -1.488879 2.485600 -1.437417
H 2.311556 -2.144829 -2.596115
H 2.691353 -1.559732 1.686504
H 0.986219 -0.045026 -2.766709
H 1.324919 0.511164 1.526386
H 3.311667 -5.306768 0.556626
H 2.636190 -4.008160 1.581193
H 1.715526 -4.589250 0.166501
H 5.398908 -2.309334 -0.498179
H 4.868564 -2.623448 1.179092
H 5.466432 -3.971001 0.170310
H -2.325610 1.871322 0.972864
H -1.976990 -1.018506 -2.245302
H -3.610199 -2.530370 -1.060865
H 2.280059 5.063725 1.018534
H 2.748395 3.748166 2.151534
H 1.020431 4.253577 1.996893
H 3.528266 3.637668 -0.574654
H 2.608709 2.330271 -1.382253
H 3.551016 1.969122 0.093686
H -3.848076 1.329565 2.866766
H -4.755597 -0.172550 2.912683


