%chk=000059373.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000059373

0 1
 Cl  -1.471000       2.301300      0.1405000    
 O  -0.8413000     -0.4373000       1.531800    
 N    1.369300      -1.509200      0.2788000    
 N    3.622700       1.435500     -0.1519000    
 N   -2.026500     -0.6131000     -0.4873000    
 C    1.942300     -0.3306000     -0.3703000    
 C    2.247900      -2.665600      0.1064000    
 C    3.039100      0.2704000      0.5038000    
 C   3.9299998E-02  -1.793100     -0.2591000    
 C    2.004000      -3.661400       1.235900    
 C    2.010200      -3.312200      -1.255200    
 C    4.566400       1.022200      -1.191600    
 C    4.289300       2.296600      0.8262000    
 C  -0.9766000     -0.8706000      0.3920000    
 C    5.133700       2.224200      -1.927500    
 C    5.445500       1.573700       1.496200    
 C   -3.165100      0.1959000     -0.2592000    
 C   -4.436200     -0.3736000     -0.3335000    
 C   -3.024500       1.551500      3.7799999E-02
 C   -5.566800      0.4125000     -0.1107000    
 C   -4.620400      -1.822700     -0.6497000    
 C   -4.155100       2.337600      0.2605000    
 C   -5.426200       1.768000      0.1863000    
 H    1.174200      0.4451000     -0.4927000    
 H    2.288800     -0.5618000      -1.381800    
 H    3.305000      -2.386900      0.1685000    
 H    2.568700      0.5660000       1.452300    
 H    3.806800     -0.4690000      0.7531000    
 H  -3.7000000E-03  -1.689600      -1.351100    
 H  -0.3199000      -2.794900      6.5000001E-03
 H    5.373900      0.3743000     -0.8323000    
 H    4.038600      0.4344000      -1.950700    
 H    4.627200       3.239000      0.3822000    
 H    3.565300       2.603300       1.592500    
 H   0.9933000      -4.081600       1.225700    
 H    2.164200      -3.190900       2.212700    
 H    2.704300      -4.500900       1.158700    
 H    1.060900      -3.852600      -1.333900    
 H    2.087900      -2.608500      -2.089800    
 H    2.788800      -4.066700      -1.427100    
 H    4.345500       2.920500      -2.234400    
 H    5.876200       2.768000      -1.336100    
 H    5.643000       1.889200      -2.838300    
 H    5.150200      0.6580000       2.015600    
 H    6.272200       1.349500      0.8166000    
 H    5.864800       2.232300       2.266800    
 H   -2.156500      -1.320000      -1.208400    
 H   -6.564700     -1.4500000E-02 -0.1657000    
 H   -4.314700      -2.030700      -1.680300    
 H   -4.037900      -2.447000      3.6200002E-02
 H   -5.667000      -2.130400     -0.5489000    
 H   -4.063300       3.395500      0.4930000    
 H   -6.306400       2.380100      0.3595000    


%chk=000059373-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000059373

0 1
Cl -0.879592 2.222640 -0.827358
O -0.442800 -0.510723 1.174723
N 1.496967 -1.998999 -0.415023
N 3.453904 1.277590 -0.301579
N -1.912526 -0.674876 -0.633130
C 2.138922 -0.766929 -0.919481
C 2.333063 -3.223580 -0.398929
C 2.759958 0.076736 0.224927
C 0.071359 -2.132073 -0.645050
C 1.946336 -4.176478 0.754831
C 2.358487 -3.971820 -1.764313
C 4.873530 1.027870 -0.642487
C 3.179765 2.525072 0.452497
C -0.752429 -1.026856 0.070192
C 5.487546 2.111637 -1.549236
C 3.790907 2.614845 1.879226
C -2.843822 0.319831 -0.187428
C -4.141504 -0.067687 0.261187
C -2.501828 1.694671 -0.190719
C -5.044802 0.934369 0.691032
C -4.531784 -1.533671 0.287764
C -3.392864 2.688455 0.254144
C -4.675431 2.297304 0.695986
H 1.392548 -0.133902 -1.435936
H 2.919703 -1.004202 -1.676551
H 3.361767 -2.866369 -0.191791
H 1.935755 0.375753 0.894875
H 3.437746 -0.573305 0.829078
H -0.218735 -2.129009 -1.731682
H -0.274321 -3.100231 -0.233235
H 5.513401 0.903727 0.269445
H 4.914637 0.059048 -1.177378
H 3.531724 3.384312 -0.149740
H 2.080398 2.626419 0.524139
H 0.959720 -4.649791 0.587866
H 1.906525 -3.620657 1.707151
H 2.686717 -4.992812 0.844484
H 1.362965 -4.394066 -2.000014
H 2.645068 -3.287432 -2.584520
H 3.082647 -4.807758 -1.746139
H 4.868852 2.245104 -2.454559
H 5.561535 3.087423 -1.035994
H 6.508897 1.819951 -1.857421
H 3.432874 1.785358 2.516168
H 4.895887 2.579242 1.855616
H 3.494672 3.565207 2.362060
H -2.090541 -1.145555 -1.524498
H -6.041144 0.639292 1.038419
H -4.637714 -1.951524 -0.732233
H -3.767211 -2.138139 0.807587
H -5.495647 -1.672727 0.805161
H -3.092530 3.739782 0.243663
H -5.381856 3.058731 1.042802


