%chk=000003818.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000003818

0 1
 O   -3.327400      -1.207000      -2.068700    
 O    5.371200       1.496300      -1.230900    
 O    6.453800      0.6791000       1.195300    
 O   -7.802200       1.798000       1.110400    
 N  -0.8511000      -1.335700     -0.6027000    
 C   -1.999300     -0.5601000     -0.1392000    
 C   0.3944000     -0.7380000     -0.1458000    
 C   -3.328500      -1.163200     -0.6355000    
 C    1.599500      -1.543800     -0.6321000    
 C    2.896500     -0.9472000     -0.1464000    
 C   -4.510700     -0.3805000     -0.1736000    
 C    3.539200      6.8999999E-03 -0.9207000    
 C    3.425500      -1.363600       1.065800    
 C   -5.507700      -1.001200      0.5789000    
 C   -4.619900      0.9725000     -0.4952000    
 C    4.739400      0.5579000     -0.4718000    
 C    4.625600     -0.8127000       1.514700    
 C    5.282600      0.1482000      0.7459000    
 C   -6.613900     -0.2688000       1.009900    
 C   -5.726000       1.704700     -6.4000003E-02
 C   -6.723000       1.084200      0.6885000    
 C    5.026100       2.860000     -0.9954000    
 C    7.656000      1.4000000E-02  0.8127000    
 H   -2.008600     -0.5105000      0.9571000    
 H   -1.890200      0.4620000     -0.5211000    
 H   0.4749000      0.2906000     -0.5200000    
 H   0.4068000     -0.6872000      0.9507000    
 H   -3.403600      -2.201800     -0.2893000    
 H    1.526800      -2.584300     -0.2883000    
 H    1.606200      -1.593600      -1.729100    
 H  -0.9229000      -2.293400     -0.2604000    
 H    3.117400      0.3288000      -1.869200    
 H    2.920400      -2.109700       1.672400    
 H   -5.437600      -2.054300      0.8376000    
 H   -3.863000       1.473400      -1.092200    
 H    5.042500      -1.135700       2.464900    
 H   -2.533100      -1.697100      -2.342000    
 H   -7.383700     -0.7640000       1.595700    
 H   -5.807000       2.757600     -0.3200000    
 H    5.616500       3.484500      -1.671400    
 H    3.964200       3.027800      -1.201300    
 H    5.258600       3.143900      3.5900000E-02
 H   -8.389900       1.211300       1.616900    
 H    8.500800      0.5598000       1.241500    
 H    7.761800      5.2000000E-03 -0.2767000    
 H    7.667700      -1.009800       1.199900    


%chk=000003818-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000003818

0 1
O -2.967943 -0.978791 -2.022484
O 5.305705 1.541309 -1.281272
O 6.569508 0.607756 1.194986
O -7.975221 1.981168 0.701577
N -0.964513 -1.501452 -0.281682
C -2.189179 -0.880911 0.284462
C 0.324515 -0.916037 0.159941
C -3.388795 -1.235590 -0.647784
C 1.513256 -1.600241 -0.561354
C 2.852245 -1.026390 -0.122424
C -4.625559 -0.419576 -0.308082
C 3.492194 -0.016226 -0.881294
C 3.463824 -1.453036 1.085119
C -5.454445 -0.796948 0.775140
C -4.947368 0.751862 -1.038232
C 4.713612 0.551702 -0.460582
C 4.696391 -0.907750 1.503318
C 5.339631 0.082448 0.730205
C -6.574439 -0.017118 1.139367
C -6.063959 1.537429 -0.690423
C -6.873959 1.154220 0.403047
C 5.459197 2.867429 -0.637760
C 7.724178 0.355184 0.300421
H -2.409670 -1.182742 1.332460
H -2.048907 0.215755 0.271670
H 0.314314 0.162016 -0.087711
H 0.473799 -0.992912 1.262821
H -3.619844 -2.319802 -0.520503
H 1.480205 -2.687780 -0.345260
H 1.371623 -1.482198 -1.651071
H -0.968699 -2.525562 -0.156997
H 3.049563 0.354254 -1.812942
H 2.984490 -2.231888 1.690577
H -5.236854 -1.713256 1.338778
H -4.321200 1.017641 -1.894859
H 5.189228 -1.245103 2.420942
H -1.977470 -1.161740 -1.999427
H -7.210920 -0.323115 1.980395
H -6.326963 2.438321 -1.252995
H 5.968335 3.496821 -1.383415
H 4.464380 3.291652 -0.403494
H 6.061173 2.793066 0.285672
H -8.480390 1.624479 1.473702
H 8.578192 0.862245 0.774769
H 7.541004 0.764623 -0.709348
H 7.920836 -0.731717 0.233725


