%chk=000154019.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000154019

0 1
 O    4.791900      0.2520000      3.8999999E-03
 O   -1.745400       2.088400     -0.2722000    
 O   -1.178600      -2.475200     -4.8500001E-02
 N   -1.367600     -0.2028000     -0.2020000    
 N   -1.938900      -1.532100      0.1956000    
 N   -3.378900      0.7726000      0.6026000    
 C    1.048700      6.8000001E-03  0.2378000    
 C    2.436900      8.3999999E-02 -0.3985000    
 C  -6.0800001E-02 -0.1492000     -0.7974000    
 C    3.530100      0.1996000      0.6550000    
 C   -2.137300      0.9558000      2.3700001E-02
 H    1.016300     -0.8374000      0.9379000    
 H   0.8704000      0.9104000      0.8345000    
 H    2.494400      0.9406000      -1.081500    
 H    2.616500     -0.8050000      -1.015700    
 H  -2.8600000E-02  0.7134000      -1.474600    
 H   0.1078000      -1.030400      -1.427100    
 H    3.524500     -0.6564000       1.337200    
 H    3.412100       1.114000       1.244500    
 H    4.901500     -0.5775000     -0.4915000    
 H   -3.750700     -0.1327000      0.8658000    
 H   -3.978900       1.569600      0.7895000    


%chk=000154019-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000154019

0 1
O 4.901528 0.279588 0.019708
O -1.733568 2.110391 -0.270113
O -1.271811 -2.464760 -0.038924
N -1.415760 -0.218686 -0.212974
N -1.996954 -1.432698 0.170571
N -3.421972 0.742384 0.610626
C 1.046302 0.004856 0.256277
C 2.443074 0.055687 -0.403186
C -0.066106 -0.125081 -0.810487
C 3.569901 0.189657 0.638466
C -2.198463 0.981272 0.037126
H 0.989419 -0.853366 0.953766
H 0.875175 0.926945 0.843715
H 2.505498 0.911425 -1.102950
H 2.603444 -0.866366 -1.001547
H -0.065209 0.755659 -1.472784
H 0.083434 -1.043844 -1.405721
H 3.524603 -0.652634 1.363090
H 3.468517 1.134039 1.199436
H 5.075062 -0.552701 -0.488576
H -3.711278 -0.213544 0.821978
H -4.019438 1.540276 0.811504


