%chk=000167465.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000167465

0 1
 O    1.512400     -0.5491000     -0.4517000    
 N  -0.6075000     -0.6084000      0.4303000    
 N  -0.7201000      -4.311100     -6.8999998E-02
 N   0.9362000       1.175800      0.9008000    
 C  -0.8729000      -1.876700     -0.2734000    
 C  -0.4395000      -3.047000      0.6003000    
 C   -1.732500     -0.1047000       1.240000    
 C   0.5730000      4.5299999E-02  0.3360000    
 C   -2.498500      0.9447000      0.4832000    
 C    2.580200      0.2982000     -0.3723000    
 C    2.224100       1.352400      0.4558000    
 C  -0.3412000      -5.440700      0.7821000    
 C  -1.6500000E-02  -4.383600      -1.351000    
 C   -2.131700       2.279100      0.6008000    
 C   -3.563700      0.5673000     -0.3241000    
 C    3.815200      0.1624000     -0.9943000    
 C    3.159100       2.368400      0.6998000    
 C   -2.842200       3.252700     -0.1011000    
 C   -4.274200       1.540900      -1.026100    
 C   -3.913500       2.883700     -0.9147000    
 C    4.736600       1.184300     -0.7406000    
 C    4.417500       2.266200      8.9199997E-02
 H   -1.940400      -1.964400     -0.5110000    
 H  -0.3579000      -1.848600      -1.238800    
 H   0.6262000      -2.959200      0.8513000    
 H  -0.9892000      -3.005100       1.549300    
 H   -1.359200      0.3071000       2.187300    
 H   -2.404700     -0.9216000       1.533800    
 H   0.7330000      -5.452300      0.9996000    
 H  -0.6078000      -6.390100      0.3043000    
 H  -0.8857000      -5.406200       1.732400    
 H    1.048900      -4.142700      -1.259700    
 H  -0.4728000      -3.735600      -2.105400    
 H  -9.1899998E-02  -5.394700      -1.770200    
 H   -1.310200       2.585200       1.241100    
 H   -3.858700     -0.4739000     -0.4161000    
 H    4.051900     -0.6783000      -1.634200    
 H    2.922600       3.211200       1.340700    
 H   -2.563500       4.298700     -1.1700000E-02
 H   -5.109300       1.253700      -1.658300    
 H   -4.467400       3.641900      -1.460500    
 H    5.722000       1.137000      -1.197900    
 H    5.158700       3.042200      0.2638000    


%chk=000167465-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000167465

0 1
O 1.824011 -0.459677 -0.434284
N -0.392858 -0.454115 0.436517
N -0.849789 -4.156542 -0.345795
N 1.202928 1.298641 0.981355
C -0.694759 -1.654772 -0.368381
C -0.406840 -2.963645 0.409988
C -1.448920 0.120814 1.311105
C 0.816615 0.170411 0.376824
C -2.505619 0.904162 0.537776
C 2.946614 0.407492 -0.280258
C 2.557193 1.468484 0.588242
C -1.053964 -5.333737 0.524369
C 0.025477 -4.473923 -1.494907
C -2.178362 2.156406 -0.046105
C -3.819435 0.396130 0.388859
C 4.211909 0.283175 -0.854649
C 3.492375 2.473647 0.908143
C -3.150373 2.880859 -0.768916
C -4.795006 1.122042 -0.333840
C -4.461421 2.365905 -0.915376
C 5.143804 1.302387 -0.522142
C 4.786676 2.372647 0.341061
H -1.763025 -1.629950 -0.648059
H -0.102601 -1.615753 -1.296837
H 0.680800 -3.000376 0.670424
H -0.969456 -2.935941 1.362783
H -0.937385 0.772844 2.039392
H -1.922809 -0.713001 1.863199
H -0.113968 -5.698705 1.010794
H -1.471580 -6.165182 -0.071582
H -1.779041 -5.089011 1.320839
H 1.070227 -4.733893 -1.187798
H 0.077572 -3.619878 -2.190901
H -0.394475 -5.331782 -2.049403
H -1.163767 2.553567 0.076927
H -4.083076 -0.567539 0.843699
H 4.473236 -0.545538 -1.518224
H 3.220029 3.299499 1.571475
H -2.890315 3.848256 -1.213261
H -5.808566 0.719662 -0.441867
H -5.215219 2.931219 -1.474963
H 6.154937 1.259071 -0.940309
H 5.533123 3.140043 0.573882


