%chk=000002527.chk
%nprocshared=4
%mem=4GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000002527

0 1
 O   -1.743300       1.224000      -1.702000    
 O   -4.932300     -0.8697000      0.1741000    
 O  -0.6392000      -1.221100      -1.368700    
 O    5.146400       1.584600      0.4794000    
 O    5.172500     -0.2473000     -0.8611000    
 N   0.2988000     -0.4705000      0.6163000    
 C   -2.899000      0.4920000      0.3202000    
 C   -1.530500      0.7894000     -0.3615000    
 C   -3.681800     -0.5993000     -0.4504000    
 C   -3.737200       1.792900      0.3305000    
 C   -2.703600      5.5900000E-02   1.785900    
 C  -0.5953000     -0.4153000     -0.4408000    
 C    1.299800      -1.504100      0.7472000    
 C    2.621100      -1.138900      7.2200000E-02
 C    3.298200      0.1040000      0.6557000    
 C    4.625200      0.4234000      3.0000000E-03
 H   -1.020300       1.609400      0.1578000    
 H   -3.904400     -0.2844000      -1.474200    
 H   -3.127500      -1.541700     -0.5028000    
 H   -3.195900       2.603600      0.8317000    
 H   -4.686900       1.657400      0.8602000    
 H   -3.973600       2.126700     -0.6857000    
 H   -3.654100      8.3999997E-03   2.328800    
 H   -2.062800      0.7649000       2.322300    
 H   -2.239100     -0.9338000       1.851000    
 H   0.2648000      0.2451000       1.336200    
 H    1.454000      -1.672000       1.818300    
 H   0.9107000      -2.432000      0.3139000    
 H   -2.085600      0.4777000      -2.221200    
 H    3.303800      -1.993600      0.1573000    
 H    2.452800     -0.9839000      -1.001200    
 H   -4.756600      -1.388800      0.9767000    
 H    3.478300     -4.4399999E-02   1.726300    
 H    2.646400      0.9748000      0.5245000    
 H    6.002100       1.803200      5.2400000E-02


%chk=000002527-Freq.chk
%nprocshared=4
%mem=4GB
#p freq=noraman PBEPBE/SDD

000002527

0 1
O -1.888710 1.235475 -1.787838
O -4.905994 -1.058844 0.306479
O -0.507353 -1.038003 -1.474731
O 5.156013 1.584280 0.468112
O 5.330487 -0.421885 -0.688879
N 0.251507 -0.449301 0.641068
C -2.947474 0.527048 0.359238
C -1.609800 0.864405 -0.402525
C -3.669679 -0.640436 -0.375940
C -3.842160 1.792154 0.319373
C -2.666354 0.141981 1.834291
C -0.578194 -0.290537 -0.442206
C 1.272541 -1.519148 0.695367
C 2.596938 -1.143573 -0.005847
C 3.290055 0.074315 0.632509
C 4.666969 0.336097 0.049916
H -1.158164 1.751336 0.087752
H -4.002342 -0.298598 -1.368388
H -2.984976 -1.503763 -0.508776
H -3.435549 2.591105 0.968732
H -4.858389 1.537955 0.669170
H -3.907455 2.181164 -0.710780
H -3.614690 0.111681 2.400254
H -2.030461 0.901633 2.330835
H -2.170218 -0.842531 1.930508
H 0.160599 0.195258 1.427724
H 1.450018 -1.766729 1.759066
H 0.846159 -2.408218 0.198889
H -1.616822 0.448076 -2.343132
H 3.275614 -2.015887 0.030884
H 2.394812 -0.949566 -1.073978
H -4.668005 -1.576922 1.115598
H 3.422473 -0.071802 1.724826
H 2.688225 0.994344 0.515884
H 6.066278 1.724038 0.088844


