%chk=000156472.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000156472

0 1
 O    4.232800      -2.449600      0.3012000    
 O    3.313300       2.668300     -0.6932000    
 O    6.272700       2.052000     -0.3112000    
 O   -3.863300     -0.8122000      0.1698000    
 N    2.585600      0.4849000     -0.6637000    
 N    4.830900     -0.2389000      0.5322000    
 C    2.502700     -0.7618000      8.2699999E-02
 C    1.635800      -1.780500     -0.6394000    
 C    4.393000       1.117100      0.8291000    
 C    3.929600      -1.259300      0.2698000    
 C    3.423000       1.518800     -0.2737000    
 C   0.1675000      -1.521700     -0.4231000    
 C    5.573800       2.070200      0.9221000    
 C  -0.4786000      -2.114200      0.6519000    
 C  -0.5160000     -0.6952000      -1.303000    
 C   -1.838400      -1.875100      0.8514000    
 C   -1.875700     -0.4559000      -1.103500    
 C   -2.536900      -1.045800     -2.6300000E-02
 C   -4.371900      0.4477000     -0.2653000    
 C   -5.503900      0.8619000      0.6217000    
 C   -6.773300       1.144400      0.2732000    
 C   -7.776200       1.552300       1.320300    
 C   -7.326500       1.092700      -1.122900    
 H    2.105900     -0.5312000       1.080000    
 H    1.851600      -2.798700     -0.2894000    
 H    1.858600      -1.796600      -1.715000    
 H    3.847000       1.098600       1.779500    
 H    1.874800      0.6993000      -1.355600    
 H    5.788700     -0.5027000      0.7437000    
 H    6.266400       1.772800       1.716400    
 H    5.246900       3.096400       1.116100    
 H   5.6600001E-02  -2.759500       1.342700    
 H  -1.7400000E-02 -0.2427000      -2.155200    
 H   -2.348000      -2.336500       1.692800    
 H   -2.387400      0.1716000      -1.827000    
 H    6.578000       1.142000     -0.4659000    
 H   -3.613800       1.237500     -0.1782000    
 H   -4.663700      0.3592000      -1.314000    
 H   -5.234900      0.9437000       1.674500    
 H   -8.167900       2.551000       1.100900    
 H   -8.613200      0.8465000       1.338500    
 H   -7.343500       1.579400       2.325900    
 H   -7.714000       2.076400      -1.408700    
 H   -6.595200      0.8015000      -1.878700    
 H   -8.150000      0.3723000      -1.172800    


%chk=000156472-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000156472

0 1
O 4.393758 -2.671715 0.792932
O 3.371238 2.705435 1.206911
O 4.371830 0.710724 -1.846282
O -3.755222 -0.349706 0.582800
N 2.621105 0.505365 1.292347
N 5.143272 -0.476376 0.715661
C 2.702400 -0.925883 0.948402
C 1.867452 -1.269685 -0.335642
C 4.954857 0.977843 0.575475
C 4.144086 -1.429245 0.810014
C 3.574569 1.463885 1.049981
C 0.385291 -1.004293 -0.131409
C 5.203568 1.444181 -0.891672
C -0.436926 -1.951753 0.540474
C -0.213351 0.201676 -0.569063
C -1.802352 -1.704871 0.764114
C -1.585687 0.469258 -0.353279
C -2.385536 -0.489681 0.317996
C -4.410068 0.916374 0.148847
C -5.830956 0.874026 0.631243
C -6.961199 0.921897 -0.131504
C -8.332144 0.893941 0.523475
C -6.988983 1.009210 -1.647054
H 2.273980 -1.509206 1.785786
H 2.051196 -2.337042 -0.558189
H 2.261770 -0.662101 -1.170455
H 5.683817 1.509105 1.217110
H 1.698014 0.859008 1.566587
H 6.098729 -0.848367 0.692847
H 6.281630 1.338016 -1.136102
H 4.910680 2.501564 -0.981995
H -0.002608 -2.901360 0.878206
H 0.397124 0.942573 -1.099978
H -2.440464 -2.434864 1.271553
H -2.010609 1.409696 -0.715400
H 4.679050 -0.231570 -1.879666
H -3.862338 1.764035 0.613279
H -4.333048 1.008841 -0.951284
H -5.936527 0.797874 1.722112
H -8.922518 1.790753 0.249607
H -8.912411 0.015808 0.177594
H -8.263287 0.849570 1.623616
H -7.431433 1.970866 -1.974616
H -5.994637 0.917983 -2.112772
H -7.631608 0.208611 -2.062010


