%chk=000110770.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000110770

0 1
 O  -0.9786000       1.315500      -1.459100    
 O    5.299500      0.7831000      0.3648000    
 N   -3.090800     -4.6999998E-02  0.2237000    
 N  -4.8300002E-02 -0.6188000     -0.4157000    
 C   -2.357300     -0.5829000     -0.9134000    
 C   -1.900100      -2.016600     -0.6919000    
 C   -4.380700     -0.7084000      0.4179000    
 C   -3.411300       1.371000      6.3500002E-02
 C   -5.108400      0.2359000       1.363200    
 C   -4.473800       1.603100       1.127800    
 C  -0.5969000      -1.871800      6.8099998E-02
 C   -1.050700      0.1832000      -1.001700    
 C    1.318300     -0.2609000     -0.2167000    
 C    1.781900      0.9952000     -0.6183000    
 C    2.202200      -1.163800      0.3812000    
 C    3.118000       1.345300     -0.4237000    
 C    3.538300     -0.8136000      0.5759000    
 C    3.996200      0.4409000      0.1734000    
 C    6.142500     -0.1893000      0.9810000    
 H   -2.909100     -0.4908000      -1.856400    
 H   -1.695100      -2.473300      -1.670000    
 H   -2.610400      -2.673800     -0.1846000    
 H   -4.291100      -1.702100      0.8665000    
 H   -4.939900     -0.7955000     -0.5226000    
 H   -3.827000       1.590600     -0.9283000    
 H   -2.561800       2.034100      0.2517000    
 H   -4.960300     -6.6100001E-02   2.406700    
 H   -6.185300      0.2496000       1.167100    
 H   -5.213000       2.341900      0.8021000    
 H   -4.022500       1.966700       2.058600    
 H  -0.7627000      -1.790900       1.147800    
 H   5.2900001E-02  -2.722200     -0.1565000    
 H    1.158100       1.744700      -1.085800    
 H    1.891400      -2.146100      0.7218000    
 H    3.470000       2.324100     -0.7384000    
 H    4.165600      -1.562100       1.048100    
 H    6.233200      -1.091000      0.3659000    
 H    5.817400     -0.4143000       2.002400    
 H    7.143000      0.2499000       1.053500    


%chk=000110770-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000110770

0 1
O -0.892910 1.314382 -1.634496
O 5.375623 0.784398 0.295532
N -3.142815 -0.077343 0.204398
N -0.060078 -0.632635 -0.539335
C -2.405660 -0.571888 -0.987133
C -1.958373 -2.040616 -0.812178
C -4.496856 -0.684463 0.366405
C -3.401555 1.395623 0.219723
C -5.185783 0.207208 1.434324
C -4.405502 1.564137 1.383780
C -0.612210 -1.927801 -0.061406
C -1.052689 0.172677 -1.114238
C 1.306234 -0.280237 -0.317416
C 1.884881 0.883783 -0.906472
C 2.121753 -1.100697 0.503772
C 3.233088 1.197197 -0.676099
C 3.479232 -0.785611 0.733941
C 4.041942 0.368851 0.141047
C 6.241672 -0.039042 1.139933
H -2.991062 -0.410316 -1.924865
H -1.797807 -2.499260 -1.804618
H -2.686250 -2.654097 -0.259366
H -4.430691 -1.741469 0.677029
H -5.068806 -0.645927 -0.596758
H -3.853408 1.733281 -0.745798
H -2.466389 1.958777 0.360705
H -5.104548 -0.248532 2.435843
H -6.259541 0.331483 1.209646
H -5.069896 2.430240 1.220142
H -3.863938 1.728467 2.330997
H -0.758419 -1.899722 1.035253
H 0.077038 -2.752983 -0.312376
H 1.265274 1.530535 -1.529807
H 1.707901 -1.989455 0.989163
H 3.682034 2.088108 -1.125773
H 4.074184 -1.442879 1.375141
H 6.343146 -1.065632 0.735584
H 5.864014 -0.087455 2.180440
H 7.220571 0.462412 1.124936


