%chk=000149619.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000149619

0 1
 O    1.724400      -1.583800      0.3936000    
 O    4.611800      -1.868100      0.6688000    
 O   0.7695000      0.9418000     -0.1972000    
 O   -3.897500      -1.098100      -2.371300    
 O   -6.161800       1.648400      0.5406000    
 O  -0.9832000       2.355300     -0.6170000    
 N   -3.427100      -1.292600     -9.2699997E-02
 N   -5.019100      0.2661000     -0.9079000    
 C   -1.038100      -1.790400     -0.4403000    
 C  -2.7000001E-03  -2.899900     -0.6272000    
 C   -2.450200      -2.334900     -0.2497000    
 C    1.403200      -2.334500     -0.7760000    
 C    2.592900     -0.5458000      0.2441000    
 C    3.970500     -0.7009000      0.3788000    
 C    2.163600      0.7503000     -5.4900002E-02
 C    4.892800      0.3313000      0.2339000    
 C    3.039700       1.824300     -0.2114000    
 C   -3.707000     -0.8324000       1.188500    
 C    4.421600       1.624000     -6.8400003E-02
 C   -4.094400     -0.7402000      -1.208100    
 C   -4.592500      0.1306000       1.472200    
 C    6.167000     -0.2573000      0.4508000    
 C   -5.335500      0.7603000      0.3484000    
 C    2.491000       3.135400     -0.5208000    
 C    5.940500      -1.589000      0.7097000    
 C   -4.877500      0.6100000       2.859300    
 C    1.173200       3.303600     -0.6524000    
 C   0.2249000       2.186700     -0.4933000    
 H   -1.015800      -1.118500      -1.307500    
 H  -0.7815000      -1.182400      0.4352000    
 H  -3.3599999E-02  -3.560900      0.2476000    
 H  -0.2508000      -3.502700      -1.508000    
 H   -2.490100      -3.011700      0.6132000    
 H   -2.719900      -2.936200      -1.126700    
 H    2.127000      -3.150700     -0.8767000    
 H    1.461200      -1.709000      -1.675900    
 H   -3.145500      -1.309800       1.986200    
 H    5.122400       2.446200     -0.1860000    
 H    7.131200      0.2302000      0.4218000    
 H   -5.511300      0.6778000      -1.695900    
 H    3.169200       3.972900     -0.6426000    
 H    6.586100      -2.426200      0.9313000    
 H   -5.932100      0.4544000       3.108700    
 H   -4.277200      7.9899997E-02   3.606400    
 H   -4.652300       1.677800       2.948700    
 H   0.7609000       4.279800     -0.8830000    


%chk=000149619-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000149619

0 1
O 1.667161 -1.666334 0.530735
O 4.436067 -1.771167 -0.762967
O 0.800368 0.760939 1.308328
O -4.485395 -2.889614 -1.574237
O -6.361172 1.315263 -0.762270
O -0.948917 1.955445 2.193413
N -3.405134 -1.464349 -0.033804
N -5.380892 -0.772859 -1.117045
C -1.035446 -2.134043 -0.556658
C 0.051742 -3.213362 -0.334604
C -2.339505 -2.471721 0.197331
C 1.463482 -2.665712 -0.564107
C 2.514710 -0.592114 0.328898
C 3.803941 -0.628561 -0.236797
C 2.098873 0.687356 0.790431
C 4.670516 0.506612 -0.336972
C 2.941835 1.847065 0.720495
C -3.360103 -0.221388 0.609140
C 4.240731 1.754704 0.153079
C -4.428312 -1.788626 -0.953429
C -4.305965 0.764436 0.431503
C 5.892625 0.016381 -0.962796
C -5.419778 0.510791 -0.493281
C 2.396889 3.085686 1.241390
C 5.716991 -1.327245 -1.198606
C -4.253227 2.094569 1.141839
C 1.122160 3.160950 1.757321
C 0.234895 2.001699 1.797702
H -1.256208 -2.029767 -1.636074
H -0.653560 -1.162894 -0.191088
H 0.006223 -3.593191 0.705320
H -0.112254 -4.081929 -1.001763
H -2.143175 -2.527159 1.284413
H -2.743531 -3.441125 -0.140275
H 2.240629 -3.446166 -0.480486
H 1.556170 -2.157254 -1.543460
H -2.507837 -0.065923 1.278894
H 4.880494 2.641166 0.103693
H 6.782177 0.595910 -1.200666
H -6.140126 -0.982744 -1.772594
H 3.026721 3.982586 1.213711
H 6.339793 -2.101357 -1.638355
H -5.123472 2.213112 1.813945
H -3.326034 2.197065 1.728274
H -4.312371 2.923248 0.412829
H 0.705124 4.092724 2.146552


