%chk=000014165.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000014165

0 1
 O    6.574500      0.2342000       1.255600    
 O    2.073600       1.184300      -1.092300    
 O   -3.824300     -0.6346000      0.1795000    
 O   -7.194300      0.2650000      0.4303000    
 O   -6.167000      -1.647700      0.7549000    
 N    4.307600     -0.2558000     -0.3944000    
 N   0.7285000     -0.5957000     -0.4642000    
 N  -0.3971000      0.1542000     -0.4909000    
 N   -6.128800     -0.4193000      0.4488000    
 C    4.178400      0.3993000      0.9146000    
 C    5.466500      -1.159300     -0.3929000    
 C    5.469600       1.138900       1.253000    
 C    6.727700     -0.3838000     -2.2800000E-02
 C    3.085100     -0.9807000     -0.7348000    
 C    1.935000      2.9000000E-03 -0.7815000    
 C   -2.777100      0.1397000     -0.1567000    
 C   -1.471600     -0.4984000     -0.1823000    
 C   -3.137200       1.419600     -0.4206000    
 C   -4.909400      0.1816000      0.1304000    
 C   -4.539700       1.455500     -0.2339000    
 H    3.979700     -0.3507000       1.692000    
 H    3.369200       1.134200      0.9500000    
 H    5.601500      -1.605800      -1.384600    
 H    5.314200      -1.972700      0.3286000    
 H    5.665800       1.955600      0.5476000    
 H    5.397600       1.576000       2.254100    
 H    7.580900      -1.067000      3.8100000E-02
 H    6.967400      0.3803000     -0.7723000    
 H    3.166000      -1.428600      -1.732200    
 H    2.877600      -1.780900     -1.3700000E-02
 H   0.6473000      -1.578200     -0.2209000    
 H   -1.448800      -1.573200      7.7399999E-02
 H   -2.494600       2.238400     -0.7113000    
 H   -5.193800       2.307900     -0.3518000    


%chk=000014165-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000014165

0 1
O 7.041537 0.286377 0.809937
O 1.964654 1.304609 -0.395335
O -4.074984 -0.737803 -0.034504
O -7.457699 0.442859 -0.129009
O -6.614949 -1.684289 0.138937
N 4.364608 -0.269499 -0.143743
N 0.642244 -0.620619 -0.143851
N -0.543010 0.064379 -0.209025
N -6.480000 -0.409414 -0.033394
C 4.583410 0.418424 1.155386
C 5.497695 -1.169601 -0.475648
C 5.914137 1.185777 1.113931
C 6.809627 -0.366206 -0.487523
C 3.066595 -0.926122 -0.260781
C 1.882234 0.065079 -0.274369
C -2.923069 0.068770 -0.163507
C -1.662592 -0.628557 -0.095693
C -3.301425 1.410356 -0.335074
C -5.160367 0.139309 -0.130924
C -4.729279 1.452970 -0.313928
H 4.606546 -0.315304 2.000749
H 3.761080 1.134381 1.325413
H 5.329804 -1.610162 -1.477498
H 5.592447 -2.006850 0.261729
H 5.852952 1.984697 0.345376
H 6.146628 1.628732 2.095903
H 7.677233 -1.027281 -0.648072
H 6.765740 0.398792 -1.291986
H 3.042693 -1.481754 -1.220893
H 2.878456 -1.688061 0.547919
H 0.657197 -1.644436 -0.002471
H -1.713232 -1.723640 0.049034
H -2.609732 2.239977 -0.459033
H -5.377179 2.319310 -0.417252


