%chk=000160415.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000160415

0 1
 O   -1.005700      0.9997000      -1.831500    
 O    1.441800       2.739700      -1.025500    
 O    3.839300     -0.8965000      0.9315000    
 N    2.056000       1.197800      0.5956000    
 N    3.390900       1.291800      0.2931000    
 C  -0.9870000      0.5825000     -0.4527000    
 C  -0.2892000       1.737200      0.3188000    
 C   -2.457500      0.3602000     -6.1400000E-02
 C  -0.1893000     -0.7205000     -0.3001000    
 C   -3.185100     -0.5670000     -0.7642000    
 C  -0.1243000      -1.305100      0.9409000    
 C   -2.974900       1.099400      0.9726000    
 C   0.4246000      -1.244600      -1.411100    
 C    1.153400       1.961300     -0.1184000    
 C   -4.518900     -0.7686000     -0.4092000    
 C   0.6004000      -2.488900       1.079600    
 C   -4.308700      0.8977000       1.327500    
 C    1.149400      -2.428400      -1.272400    
 C   -5.080600     -3.6200002E-02  0.6366000    
 C    1.237200      -3.050400     -2.7100001E-02
 C    4.201400      0.1934000      0.4947000    
 C    5.626700      0.4455000      8.2800001E-02
 H  -0.8061000       2.691000      0.1450000    
 H  -0.2812000       1.562500       1.402500    
 H   -2.763000      -1.139500      -1.583900    
 H  -0.6105000     -0.8783000       1.812200    
 H   -2.422200       1.835200       1.542200    
 H   0.3814000     -0.7870000      -2.393100    
 H   -1.617500       1.751600      -1.914500    
 H   -5.120500      -1.494700     -0.9481000    
 H   0.6705000      -2.972300       2.049600    
 H   -4.746900       1.467300       2.141900    
 H    1.646900      -2.865100      -2.133400    
 H   -6.119300     -0.1931000      0.9127000    
 H    1.802700      -3.971300      8.1200004E-02
 H    1.801400      0.6013000       1.375600    
 H    3.724300       2.180200     -6.7199998E-02
 H    6.292600     -0.2011000      0.6611000    
 H    5.737500      0.2233000     -0.9819000    
 H    5.910400       1.485800      0.2664000    


%chk=000160415-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000160415

0 1
O -0.968216 0.391167 -2.100011
O 1.654804 1.038479 -1.671644
O 4.232492 2.019052 2.245604
N 2.289642 1.507767 0.482076
N 3.630665 1.553907 0.077769
C -0.970478 0.118408 -0.654671
C -0.121209 1.243096 0.040807
C -2.431236 0.262534 -0.176267
C -0.418926 -1.299250 -0.386252
C -3.352791 1.009566 -0.950220
C 0.305059 -1.642522 0.783019
C -2.854273 -0.288754 1.058921
C -0.686688 -2.313549 -1.340776
C 1.318845 1.249162 -0.448358
C -4.675941 1.203320 -0.493422
C 0.760493 -2.965410 0.989934
C -4.175377 -0.089226 1.517670
C -0.238726 -3.635091 -1.133923
C -5.091666 0.660121 0.743929
C 0.489486 -3.967819 0.032959
C 4.589292 1.819312 1.039109
C 6.023040 1.850200 0.549722
H -0.592103 2.202692 -0.244597
H -0.175153 1.166647 1.141141
H -3.021625 1.409588 -1.912335
H 0.526297 -0.888493 1.547453
H -2.163089 -0.897327 1.652811
H -1.239293 -2.043176 -2.245890
H -0.004879 0.525296 -2.356873
H -5.382626 1.776313 -1.104784
H 1.324337 -3.209679 1.897517
H -4.491022 -0.525445 2.472267
H -0.455017 -4.405643 -1.882684
H -6.117926 0.811318 1.097536
H 0.840892 -4.993358 0.192809
H 2.166782 1.694744 1.484337
H 3.768719 1.359157 -0.918747
H 6.462888 2.836153 0.777796
H 6.610116 1.093227 1.097515
H 6.114813 1.659317 -0.532849


