%chk=000027495.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000027495

0 1
 O   -1.710300      0.5264000      -1.618500    
 O    3.478500      1.1500000E-02   2.038400    
 N   -2.973200       1.910200     -0.2487000    
 N    1.813500       1.589200      0.4913000    
 N    3.003600       1.055100      2.1199999E-02
 N    7.400300      -1.208900     -0.7521000    
 C   -4.245300       1.635500     -0.8729000    
 C   -4.944400      0.4701000     -0.2345000    
 C  -0.6023000       1.775200      0.1357000    
 C   0.7001000       1.134700     -0.3325000    
 C   -1.795900       1.319900     -0.6852000    
 C   -4.720700     -0.8140000     -0.7169000    
 C   -5.369200      -1.896700     -0.1229000    
 C   -5.806900      0.6870000      0.8335000    
 C   -6.236500      -1.687800      0.9492000    
 C   -6.455300     -0.3958000       1.427400    
 C   -5.136500      -3.278100     -0.6347000    
 C    3.767000      0.2777000      0.8742000    
 C    5.037900     -0.2420000      0.3054000    
 C    6.084000     -0.5162000       1.153800    
 C    5.130000     -0.4339000      -1.052600    
 C    7.246400     -0.9989000      0.5745000    
 C    6.335200     -0.9202000      -1.533200    
 H   -4.854800       2.542500     -0.7882000    
 H   -4.098700       1.453900      -1.944400    
 H  -0.5360000       2.867900      6.2199999E-02
 H  -0.7939000       1.518900       1.185200    
 H   0.8735000       1.390100      -1.386000    
 H   0.6126000      4.2399999E-02 -0.2722000    
 H   -2.953500       2.543400      0.5455000    
 H   -4.050100     -0.9782000      -1.556200    
 H   -5.983300       1.688700       1.215500    
 H    1.897700       2.603200      0.4263000    
 H   -6.749300      -2.522700       1.419400    
 H   -7.130600     -0.2329000       2.262300    
 H   -4.116100      -3.389900      -1.017000    
 H   -5.840800      -3.503400      -1.441600    
 H   -5.263900      -4.021900      0.1592000    
 H    3.298400       1.327600     -0.9108000    
 H    6.030000     -0.3664000       2.225800    
 H    4.320200     -0.2594000      -1.750100    
 H    8.113400      -1.235600       1.182700    
 H    6.477500      -1.103300      -2.593200    


%chk=000027495-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000027495

0 1
O -1.782784 2.232232 -1.877004
O 3.479482 0.229224 2.048911
N -2.973273 1.875158 0.093789
N 1.876645 1.887987 0.372119
N 3.032210 1.200526 -0.045568
N 7.115439 -1.811448 -0.908644
C -4.284848 1.727585 -0.564792
C -5.008240 0.446072 -0.165907
C -0.547142 2.288339 0.245820
C 0.652848 1.561368 -0.394720
C -1.808733 2.127071 -0.610472
C -4.353461 -0.808381 -0.250583
C -5.014724 -2.013945 0.088467
C -6.352779 0.492736 0.274380
C -6.363083 -1.943210 0.529131
C -7.027218 -0.700744 0.618533
C -4.309890 -3.353476 -0.042348
C 3.738411 0.362765 0.821764
C 4.893640 -0.371165 0.169059
C 5.981529 -0.757748 0.989850
C 4.931000 -0.740190 -1.200171
C 7.060269 -1.461904 0.413723
C 6.051369 -1.453174 -1.686164
H -4.922494 2.604138 -0.336920
H -4.070474 1.749076 -1.650156
H -0.325463 3.374354 0.304653
H -0.691436 1.926574 1.279695
H 0.706027 1.846495 -1.469806
H 0.505131 0.468155 -0.342238
H -2.929701 1.767450 1.108947
H -3.310685 -0.842714 -0.591694
H -6.869493 1.457658 0.349537
H 2.048279 2.896503 0.487692
H -6.890154 -2.865108 0.803899
H -8.066642 -0.661148 0.963393
H -3.220076 -3.256025 0.105823
H -4.466404 -3.786379 -1.049591
H -4.691071 -4.085491 0.691309
H 3.374357 1.321304 -1.008624
H 5.961486 -0.514471 2.056250
H 4.100259 -0.524498 -1.881413
H 7.919269 -1.766956 1.021317
H 6.104919 -1.759697 -2.736948


