%chk=000021663.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000021663

0 1
 O    1.421000     -0.1892000      -1.266800    
 O   0.2936000       1.566200     -0.2938000    
 O   -5.767300       2.127500      0.4501000    
 N    4.568300       1.043600      0.2514000    
 C    3.330400      0.2884000      0.1138000    
 C    2.631900      0.5650000      -1.219800    
 C  -0.9120000     -0.4611000     -0.9361000    
 C    4.286000       2.448200      0.5551000    
 C    5.416400      0.4608000       1.293400    
 C    3.470100      0.1666000      -2.427900    
 C   0.3099000      0.4360000     -0.7650000    
 C   -2.216300      0.2329000     -0.5643000    
 C  -0.7775000      -1.820200     -0.2623000    
 C    5.567200       3.261000      0.6343000    
 C    5.723100     -0.9978000      0.9996000    
 C   -3.160700      0.5188000      -1.550200    
 C   -2.465100      0.5838000      0.7627000    
 C   -1.434800      -2.930100     -0.7935000    
 C   3.4000000E-03  -1.955500      0.8856000    
 C   -4.353900       1.155600      -1.209300    
 C   -3.658500       1.220700       1.103600    
 C   -4.602800       1.506600      0.1175000    
 C   -1.311400      -4.175100     -0.1767000    
 C   0.1268000      -3.200700       1.502300    
 C  -0.5306000      -4.310300      0.9711000    
 C   -5.957100       2.458400       1.825100    
 H    2.649600      0.4861000      0.9530000    
 H    3.477000     -0.7957000      0.1302000    
 H    2.400100       1.629200      -1.337500    
 H  -0.9413000     -0.6477000      -2.021200    
 H    3.679600       2.896800     -0.2381000    
 H    3.724200       2.558100       1.491500    
 H    6.387000      0.9664000       1.324000    
 H    4.963400      0.5488000       2.289000    
 H    3.727900     -0.8977000      -2.391300    
 H    4.393900      0.7488000      -2.494300    
 H    2.901000      0.3180000      -3.351900    
 H    6.126100       3.074600       1.556400    
 H    6.221200       3.072700     -0.2241000    
 H    5.323100       4.329300      0.6292000    
 H    4.907100      -1.668400       1.285500    
 H    5.975700      -1.162200     -5.3700000E-02
 H    6.591800      -1.311200       1.590600    
 H   -2.982200      0.2522000      -2.588400    
 H   -1.739700      0.3772000       1.544600    
 H   -2.046200      -2.838000      -1.687200    
 H   0.5145000      -1.107500       1.331900    
 H   -5.085900       1.375700      -1.981600    
 H   -3.786700       1.466700       2.152200    
 H   -1.823400      -5.039000     -0.5900000    
 H   0.7319000      -3.305600       2.398000    
 H  -0.4352000      -5.279500       1.451800    
 H   -5.991900       1.562000       2.453600    
 H   -5.209700       3.180000       2.172100    
 H   -6.934200       2.945300       1.908400    


%chk=000021663-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000021663

0 1
O 1.267735 -0.053787 -1.148416
O 0.677953 0.604953 1.009594
O -5.499728 2.372569 -0.732319
N 4.723275 0.866441 0.071537
C 3.615523 -0.023794 -0.351266
C 2.512558 0.797413 -1.062703
C -0.785697 -0.947497 -0.278657
C 4.457393 1.496332 1.397874
C 6.065668 0.230626 -0.013946
C 2.864051 1.191284 -2.493551
C 0.440046 -0.060185 -0.028660
C -2.045706 -0.063587 -0.345336
C -0.907173 -2.094652 0.738427
C 5.170726 2.849814 1.573846
C 6.576996 0.091910 -1.460315
C -2.663767 0.184588 -1.598512
C -2.602770 0.530269 0.810670
C -1.443244 -3.329410 0.290027
C -0.546144 -1.963142 2.103659
C -3.809147 0.995630 -1.696985
C -3.750021 1.349711 0.730548
C -4.356920 1.581528 -0.529306
C -1.619848 -4.409622 1.181707
C -0.719424 -3.046110 2.995712
C -1.257395 -4.271557 2.541800
C -6.103713 3.001080 0.444481
H 3.165912 -0.567398 0.511877
H 3.997653 -0.785477 -1.054347
H 2.260555 1.680481 -0.447602
H -0.639886 -1.392242 -1.277939
H 3.365970 1.649050 1.486576
H 4.742011 0.805852 2.231344
H 6.771616 0.870071 0.546652
H 6.076807 -0.769084 0.489929
H 2.976514 0.295610 -3.130617
H 3.822220 1.739509 -2.478819
H 2.086807 1.839129 -2.933473
H 6.269836 2.750181 1.512090
H 4.849691 3.555873 0.788200
H 4.929277 3.285582 2.561327
H 5.916267 -0.548334 -2.072807
H 6.630382 1.084387 -1.941171
H 7.585448 -0.362196 -1.470816
H -2.242222 -0.259757 -2.508344
H -2.138700 0.356134 1.786637
H -1.730327 -3.441660 -0.762947
H -0.118665 -1.020252 2.460502
H -4.293241 1.188880 -2.659016
H -4.156423 1.794162 1.643992
H -2.035401 -5.355710 0.816507
H -0.431819 -2.931183 4.047158
H -1.390281 -5.108865 3.236160
H -6.444035 2.243054 1.176803
H -5.398525 3.699868 0.935497
H -6.969867 3.559030 0.059336


