%chk=000131653.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000131653

0 1
 O   -5.068900       1.201200      0.5543000    
 N  -0.1356000      -1.039000     -0.2843000    
 N    2.906700      0.2254000     -6.4800002E-02
 C   0.5664000      2.6100000E-02 -0.7815000    
 C   -1.431100     -0.6654000     -5.7000001E-03
 C   -1.550100      0.6853000     -0.3398000    
 C  -0.2821000       1.108100     -0.8280000    
 C    1.987900     -7.7699997E-02  -1.170600    
 C   -2.495700      -1.412200      0.5113000    
 C   0.4051000      -2.367100     -8.0200002E-02
 C   -2.791600       1.324100     -0.1497000    
 C   -3.865500      0.5896000      0.3666000    
 C   -3.717500     -0.7574000      0.6913000    
 C    4.286200      9.7900003E-02 -0.5005000    
 C    5.211600      0.4053000      0.5943000    
 C    5.974100      0.6558000       1.487400    
 H  -2.1199999E-02   2.098900      -1.175000    
 H    2.201600      -1.073800      -1.577100    
 H    2.171600      0.6276000      -1.992500    
 H   -2.398500      -2.462000      0.7647000    
 H   0.4562000      -2.865600      -1.051400    
 H    1.399000      -2.286600      0.3669000    
 H  -0.2284000      -2.937800      0.6007000    
 H   -2.907100       2.374500     -0.4026000    
 H    2.737300       1.180200      0.2534000    
 H   -4.561600      -1.314800       1.090700    
 H    4.479600     -0.9242000     -0.8476000    
 H    4.488300      0.7750000      -1.339100    
 H   -4.996500       2.131200      0.2789000    
 H    6.650100      0.8781000       2.279700    


%chk=000131653-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000131653

0 1
O -5.282687 0.979978 0.452321
N -0.051237 -0.895351 -0.193252
N 2.914897 0.071454 -0.157341
C 0.541219 0.192583 -0.862900
C -1.399703 -0.588508 0.048425
C -1.656888 0.729412 -0.473982
C -0.415789 1.198658 -1.043180
C 1.977243 0.184261 -1.308018
C -2.408961 -1.350264 0.679593
C 0.601880 -2.159650 0.159335
C -2.958996 1.285401 -0.351165
C -3.956442 0.518450 0.281106
C -3.691984 -0.785462 0.792747
C 4.343410 0.107679 -0.561450
C 5.249282 0.051400 0.599215
C 6.018557 0.024529 1.561797
H -0.235228 2.155825 -1.530389
H 2.175847 -0.679884 -1.977012
H 2.147917 1.102555 -1.918712
H -2.215140 -2.355175 1.068888
H 0.357219 -2.959760 -0.565617
H 1.691296 -1.995278 0.191915
H 0.274311 -2.483763 1.163107
H -3.179245 2.287759 -0.740635
H 2.704559 0.764732 0.573761
H -4.511844 -1.329781 1.270207
H 4.536848 -0.766724 -1.215521
H 4.598378 1.013665 -1.167528
H -5.384370 1.886551 0.070370
H 6.685950 -0.004591 2.403716


