%chk=000108754.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000108754

0 1
 O    1.449400       2.450700      0.7452000    
 O    3.380800      -1.919500      0.3383000    
 O    4.819000      0.2949000      0.4579000    
 N   -4.197800      0.8657000     -0.2656000    
 N   -4.076300      -1.117800       1.097700    
 N   -2.550400       1.281100      -1.920100    
 N   -5.815600      0.4321000       1.377800    
 C   9.5299996E-02 -0.6501000     -0.6329000    
 C   -1.159600      -1.145500      -1.268600    
 C    2.442900      0.2767000      0.5560000    
 C    1.369400       1.145900      0.3611000    
 C    2.342400      -1.056100      0.1564000    
 C   0.1957000      0.6824000     -0.2333000    
 C    1.168600      -1.519400     -0.4380000    
 C   -2.424300     -0.6951000     -0.5655000    
 C    3.700800      0.7733000       1.193100    
 C   -3.071600      0.4613000     -0.8888000    
 C   -2.953800      -1.461300      0.4325000    
 C   -4.638400      4.0700000E-02  0.7035000    
 C    1.945100       3.379800     -0.2164000    
 C    3.190600      -3.263100     -0.1002000    
 C    4.787800      0.7432000     -0.8904000    
 H   -1.163500     -0.8774000      -2.330700    
 H   -1.165700      -2.245000      -1.277000    
 H  -0.6061000       1.396400     -0.3655000    
 H    1.034800      -2.543000     -0.7707000    
 H    3.769200       1.863000       1.264800    
 H    3.770300      0.3789000       2.212900    
 H   -2.501100      -2.393500      0.7524000    
 H    2.353000       4.242700      0.3171000    
 H    1.120000       3.717800     -0.8508000    
 H    2.730500       2.948200     -0.8421000    
 H    3.045900      -3.317800      -1.184600    
 H    2.388500      -3.760500      0.4558000    
 H    4.114300      -3.807300      0.1230000    
 H   -2.104200      0.8477000      -2.717100    
 H   -3.058000       2.140000      -2.098400    
 H    5.730200      0.4385000      -1.356300    
 H    4.741800       1.835300     -0.9350000    
 H    3.984400      0.2989000      -1.482600    
 H   -6.273800       1.294500       1.117800    
 H   -6.185200     -0.1539000       2.113400    


%chk=000108754-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000108754

0 1
O 2.156540 1.946915 1.327766
O 3.564343 -2.114104 -0.735805
O 4.572290 0.994036 -1.175152
N -3.485907 0.717232 -1.590989
N -4.477738 0.506785 0.641401
N -1.492868 -0.349664 -2.165511
N -5.495750 1.783896 -1.041709
C 0.142308 -1.089270 0.427872
C -1.287456 -1.635956 0.523264
C 2.824801 -0.086663 0.269909
C 1.775307 0.682009 0.846874
C 2.490536 -1.382115 -0.211817
C 0.447288 0.196325 0.926548
C 1.163895 -1.882198 -0.145134
C -2.381519 -0.667971 0.110309
C 4.242341 0.442218 0.160227
C -2.454051 -0.095420 -1.208705
C -3.432892 -0.308331 0.975293
C -4.451184 0.973930 -0.653069
C 1.130721 2.777118 1.964440
C 3.299868 -3.461292 -1.242277
C 3.817378 2.203328 -1.502318
H -1.350126 -2.562372 -0.084561
H -1.482421 -1.944569 1.570314
H -0.356671 0.801910 1.354173
H 0.920719 -2.885171 -0.510469
H 4.414971 1.216641 0.932578
H 4.962857 -0.381538 0.277114
H -3.450880 -0.699597 2.001408
H 1.654240 3.696320 2.266066
H 0.706566 2.278818 2.857283
H 0.316426 3.025875 1.257214
H 2.586674 -3.440093 -2.089098
H 2.911370 -4.125443 -0.445472
H 4.275165 -3.830708 -1.591067
H -0.604496 -0.780864 -1.915653
H -1.599606 0.104867 -3.070734
H 4.234940 2.568859 -2.454830
H 3.932049 2.979117 -0.717045
H 2.735173 1.994393 -1.630939
H -5.518841 2.146813 -1.990004
H -6.231059 1.989333 -0.371598


