%chk=000091726.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000091726

0 1
 O   -3.700600      0.7422000      0.5716000    
 O   -4.564200      -1.069000     -0.6483000    
 O   -1.122300      8.5000001E-02 -0.3407000    
 N   8.3200000E-02 -0.6142000     -0.2006000    
 N   0.3228000       2.666100     -0.3079000    
 C   -3.492800     -0.1213000     -0.5544000    
 C   -4.801000      0.1642000       1.273200    
 C   -5.583000     -0.5281000      0.1908000    
 C   -2.177700     -0.8613000     -0.4024000    
 C    2.528800     -9.8700002E-02  7.9999998E-04
 C    1.095300      0.1882000     -0.1372000    
 C    3.435200      0.9516000      3.7799999E-02
 C    2.956400      -1.415900      9.2699997E-02
 C    4.796800      0.6793000      0.1692000    
 C    4.318100      -1.688100      0.2241000    
 C    5.238300     -0.6404000      0.2623000    
 C   0.6666000       1.560300     -0.2308000    
 H   -3.483900      0.5047000      -1.453700    
 H   -5.372600      0.9331000       1.798600    
 H   -4.400800     -0.5507000       2.000200    
 H   -6.237800      -1.318600      0.5655000    
 H   -6.170800      0.1824000     -0.4005000    
 H   -2.026300      -1.544500      -1.246700    
 H   -2.183300      -1.455400      0.5200000    
 H    3.139100       1.993400     -3.0999999E-02
 H    2.253700      -2.244000      6.4800002E-02
 H    5.513900       1.494500      0.1990000    
 H    4.662200      -2.715700      0.2967000    
 H    6.298600     -0.8524000      0.3646000    


%chk=000091726-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000091726

0 1
O -3.955486 0.708152 0.763431
O -4.504108 -0.987782 -0.808790
O -1.109615 0.335721 -0.367157
N 0.158551 -0.306503 -0.170446
N 0.783518 3.138715 -0.692595
C -3.501170 0.046357 -0.467522
C -4.980368 -0.183898 1.359366
C -5.650059 -0.788614 0.113784
C -2.173266 -0.696134 -0.309337
C 2.550919 0.071316 -0.044843
C 1.164041 0.565375 -0.233303
C 3.646437 0.974835 -0.106349
C 2.800987 -1.308972 0.199231
C 4.966020 0.507282 0.072813
C 4.119311 -1.768012 0.376763
C 5.208559 -0.863486 0.314880
C 0.948991 1.973605 -0.482701
H -3.443845 0.831255 -1.243681
H -5.639788 0.450803 1.970030
H -4.506656 -0.963749 1.987866
H -6.108349 -1.776614 0.275912
H -6.381000 -0.089282 -0.334517
H -2.037785 -1.406370 -1.144504
H -2.124881 -1.229832 0.655727
H 3.466842 2.039593 -0.293414
H 1.956465 -2.003144 0.245939
H 5.801842 1.213259 0.023285
H 4.302723 -2.831698 0.563839
H 6.233069 -1.225480 0.453994


