%chk=000097678.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000097678

0 1
 O   -1.763300       1.327200      0.3083000    
 O   -1.709200     -0.8577000     -0.6433000    
 O   -3.977600      0.7405000      6.5000001E-03
 O  -0.8366000      -2.765100      0.3286000    
 O    4.466100      0.7306000     -0.7870000    
 O    2.767200       1.167300      -2.106700    
 N    3.232300      0.7611000      -1.014400    
 C   9.8399997E-02 -8.2999997E-02  0.7610000    
 C   -1.392100     -5.3900000E-02  0.5135000    
 C   0.9597000      0.3479000     -0.2345000    
 C   0.5740000     -0.5389000       1.979600    
 C    2.335400      0.3221000     -5.1000002E-03
 C    1.949500     -0.5646000       2.209000    
 C    2.830300     -0.1340000       1.216800    
 C   -3.082400       1.572400      6.6299997E-02
 C   -1.379200      -2.179900     -0.5985000    
 C   -3.291500       3.044800     -0.1161000    
 C   -1.781000      -2.836800      -1.884000    
 H   -1.952500     -0.4350000       1.377300    
 H   0.5499000      0.6997000      -1.178000    
 H  -0.1021000     -0.8758000       2.759800    
 H    2.334300     -0.9198000       3.160500    
 H    3.895400     -0.1682000       1.431000    
 H   -4.348000       3.238200     -0.3228000    
 H   -2.701000       3.401000     -0.9640000    
 H   -3.012300       3.575000      0.7979000    
 H   -2.860300      -2.741700      -2.027700    
 H   -1.239500      -2.382000      -2.717300    
 H   -1.528100      -3.900100      -1.842400    


%chk=000097678-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000097678

0 1
O -1.570520 1.219135 -0.092350
O -1.493868 -1.035982 -0.724297
O -3.799230 0.674731 0.372557
O -1.992683 -2.688111 0.852635
O 4.730461 1.652801 -0.128824
O 2.947382 2.587384 -1.198904
N 3.468205 1.728392 -0.388799
C 0.320519 -0.082251 0.660671
C -1.166549 -0.090004 0.389687
C 1.179525 0.830601 0.012845
C 0.850539 -1.034937 1.567294
C 2.559453 0.764972 0.288336
C 2.239435 -1.080099 1.823543
C 3.112080 -0.176377 1.183932
C -2.970572 1.487437 -0.076315
C -1.986543 -2.301412 -0.335669
C -3.234827 2.844261 -0.676678
C -2.476644 -3.062712 -1.542492
H -1.765001 -0.398062 1.266707
H 0.791173 1.581117 -0.678811
H 0.173135 -1.743178 2.057439
H 2.639979 -1.817928 2.525391
H 4.190425 -0.182595 1.362388
H -4.281086 3.131877 -0.500759
H -3.044379 2.809747 -1.764430
H -2.552565 3.597034 -0.248486
H -3.456343 -2.657464 -1.854371
H -1.781396 -2.940875 -2.388688
H -2.594307 -4.126201 -1.289252


