%chk=000086321.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000086321

0 1
 O   -2.276700       1.593600     -0.6972000    
 O   -3.383200     -0.9238000     -0.2528000    
 N   0.6024000     -0.4842000      0.3456000    
 C    2.046700     -0.3837000      0.5720000    
 C  -0.1656000      0.6331000     -6.4199999E-02
 C    2.817100     -0.7094000     -0.7033000    
 C   0.5469000       1.949800     -0.2630000    
 C  -4.1600000E-02  -1.695100      0.5559000    
 C   -1.501300      0.5318000     -0.2869000    
 C    4.324100     -0.5754000     -0.5330000    
 C   -1.346400      -1.919500      0.3849000    
 C   -2.178700     -0.7844000     -6.7400001E-02
 C   0.5563000       2.767200       1.009300    
 H    2.346200      -1.093000       1.356200    
 H    2.344000      0.5914000      0.9695000    
 H    2.496400     -5.9400000E-02  -1.525300    
 H    2.588900      -1.734900      -1.019100    
 H    1.570300       1.815100     -0.6240000    
 H   8.7300003E-02   2.535200      -1.068000    
 H   0.6128000      -2.497700      0.8793000    
 H    4.596100      0.4494000     -0.2614000    
 H    4.690100      -1.248000      0.2491000    
 H    4.835800     -0.8279000      -1.466900    
 H   -1.804100      -2.884400      0.5581000    
 H    1.106700       3.700700      0.8522000    
 H    1.031600       2.236900       1.840300    
 H  -0.4598000       3.032600       1.321000    
 H   -1.783800       2.424300     -0.6256000    


%chk=000086321-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000086321

0 1
O -2.332721 1.550324 -0.655699
O -3.490447 -0.926629 -0.259593
N 0.622141 -0.466944 0.390802
C 2.098581 -0.407631 0.544011
C -0.135593 0.638548 -0.057174
C 2.864594 -0.711770 -0.765718
C 0.544409 1.988507 -0.230271
C -0.006006 -1.689573 0.595468
C -1.508614 0.488555 -0.258423
C 4.392482 -0.673946 -0.551538
C -1.357859 -1.872224 0.391301
C -2.234893 -0.792488 -0.061648
C 0.473748 2.870397 1.047632
H 2.381704 -1.149563 1.313535
H 2.393477 0.579916 0.939579
H 2.572342 0.017657 -1.545715
H 2.555466 -1.707159 -1.137930
H 1.597022 1.863483 -0.537984
H 0.076555 2.529563 -1.078409
H 0.644726 -2.500989 0.934684
H 4.726621 0.319928 -0.198297
H 4.711944 -1.422429 0.197803
H 4.927655 -0.892469 -1.492190
H -1.812197 -2.849650 0.574714
H 0.939621 3.857355 0.873977
H 0.999671 2.387400 1.890863
H -0.572276 3.030024 1.364571
H -1.813653 2.382106 -0.793050


