%chk=000149618.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000149618

0 1
 O   -1.844400     -0.8363000     -0.1454000    
 O   -3.888200      -2.913300     -9.2100002E-02
 O   -2.715400       1.777800      7.4500002E-02
 O    4.462400      -1.021500       2.225000    
 O    8.628700     -0.6095000      0.3223000    
 O   -2.264200       4.021600      0.1612000    
 N    4.652000      0.2329000      0.2651000    
 N    6.534700     -0.8072000       1.265800    
 C   0.9611000     -0.1148000     -0.6692000    
 C    2.452800     -0.4578000     -0.6088000    
 C   0.1755000      -1.192000      -1.423800    
 C    3.256000      0.5658000      0.1876000    
 C   -1.317700     -0.8911000      -1.469900    
 C   -3.173900     -0.5704000     -1.8200001E-02
 C   -4.136500      -1.576700      5.7999999E-03
 C   -3.667500      0.7320000      9.6500002E-02
 C    5.504400      0.7123000     -0.7225000    
 C   -5.503600      -1.349900      0.1344000    
 C   -5.025700       1.021600      0.2275000    
 C    5.157900     -0.5625000       1.316500    
 C   -5.963000     -2.3100000E-02  0.2486000    
 C    6.821300      0.4762000     -0.7680000    
 C   -6.110900      -2.633600      0.1124000    
 C    7.427400     -0.3550000      0.3059000    
 C   -5.437100       2.412300      0.3389000    
 C   -5.089300      -3.544100     -2.6100000E-02
 C    7.719600       1.002600      -1.840800    
 C   -4.528700       3.390500      0.3164000    
 C   -3.087700       3.113500      0.1802000    
 H   0.5740000     -1.5200000E-02  0.3518000    
 H   0.8256000      0.8551000      -1.162800    
 H    2.851600     -0.5270000      -1.628600    
 H    2.581100      -1.450200     -0.1582000    
 H   0.3288000      -2.155800     -0.9229000    
 H   0.5587000      -1.284900      -2.446400    
 H    2.853400      0.6184000       1.206900    
 H    3.137800       1.568000     -0.2433000    
 H   -1.829000      -1.681400      -2.032400    
 H   -1.492100      6.4700000E-02  -1.978600    
 H    5.030500       1.312400      -1.493600    
 H   -7.025900      0.1794000      0.3496000    
 H    6.920400      -1.378000       2.012900    
 H   -7.163900      -2.865400      0.1882000    
 H   -6.492300       2.641200      0.4403000    
 H   -5.054100      -4.621700     -9.0800002E-02
 H    8.202000      0.1775000      -2.374700    
 H    7.170900       1.599400      -2.577000    
 H    8.497900       1.640400      -1.409300    
 H   -4.832100       4.428500      0.3991000    


%chk=000149618-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000149618

0 1
O -2.012905 -1.573983 -0.689619
O -4.408809 -3.098403 -0.027075
O -2.249249 1.265430 -0.521942
O 4.425499 -1.520467 2.013111
O 8.565187 -0.100077 0.356688
O -1.214376 3.312681 -0.716075
N 4.451363 0.191932 0.393091
N 6.471158 -0.759233 1.155762
C 0.814439 -0.514699 -0.758376
C 2.348245 -0.677665 -0.697901
C 0.160970 -1.448689 -1.800570
C 2.965549 0.244375 0.376041
C -1.336705 -1.196308 -1.976330
C -3.197974 -0.937782 -0.346989
C -4.328492 -1.698001 0.014538
C -3.362187 0.470164 -0.211150
C 5.199186 1.005887 -0.459174
C -5.564413 -1.145408 0.481433
C -4.588948 1.065761 0.242373
C 5.069626 -0.753420 1.244192
C -5.698601 0.251680 0.590814
C 6.573491 0.981211 -0.538474
C -6.437082 -2.283924 0.736149
C 7.306592 0.037863 0.318697
C -4.621796 2.511018 0.345457
C -5.718482 -3.416035 0.425744
C 7.370562 1.874637 -1.455992
C -3.531722 3.293631 0.035996
C -2.267892 2.718631 -0.414022
H 0.373182 -0.726649 0.234128
H 0.557235 0.537416 -0.995435
H 2.788938 -0.440106 -1.687997
H 2.613482 -1.726909 -0.465164
H 0.320749 -2.507191 -1.517438
H 0.638674 -1.305076 -2.792209
H 2.617307 -0.062486 1.376566
H 2.662598 1.294395 0.207011
H -1.771633 -1.842306 -2.762729
H -1.535893 -0.135212 -2.203471
H 4.608430 1.692208 -1.073581
H -6.627185 0.714436 0.939217
H 6.947384 -1.429820 1.767437
H -7.460774 -2.255185 1.103326
H -5.550441 2.983779 0.686495
H -5.940957 -4.479124 0.456283
H 7.989914 1.273694 -2.146426
H 6.713383 2.532548 -2.050378
H 8.072251 2.503427 -0.878236
H -3.555578 4.383057 0.116203


