%chk=000051032.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000051032

0 1
 O    1.133800     -0.9853000       1.456900    
 O   -5.977000      -1.464100      -1.440300    
 N    2.451200       1.609600     -0.4317000    
 N    2.641400      0.3826000      0.2257000    
 N  -0.8890000      0.9351000      0.7239000    
 C    1.092200       1.915000     -0.3555000    
 C   0.4179000       1.015400      0.3756000    
 C    1.424400      2.0999999E-03  0.8009000    
 C    3.776400     -0.4420000      2.5200000E-02
 C    3.462300       2.649500     -0.2675000    
 C   0.5447000       3.144900     -0.9988000    
 C    4.038200      -1.503900      0.8967000    
 C    4.642600     -0.2006000      -1.045800    
 C    5.155000      -2.315900      0.6995000    
 C    5.759400      -1.012800      -1.243100    
 C   -1.650800      0.2814000     -9.7000003E-02
 C   -3.095500      0.1063000      0.1419000    
 C    6.015500      -2.070500     -0.3704000    
 C   -3.852400     -0.6030000     -0.7754000    
 C   -3.665000      0.6549000       1.278800    
 C   -5.218900     -0.7688000     -0.5492000    
 C   -5.031300      0.4891000       1.505100    
 C   -5.808300     -0.2227000      0.5911000    
 C   -7.367000      -1.596500      -1.146400    
 H    4.480600       2.262200     -0.1850000    
 H    3.267600       3.229700      0.6421000    
 H    3.440200       3.333100      -1.122800    
 H  -0.5442000       3.202800     -0.9015000    
 H   0.7825000       3.153200      -2.067400    
 H   0.9667000       4.045000     -0.5410000    
 H    3.409600      -1.710500       1.756800    
 H    4.458700      0.5879000      -1.770100    
 H    5.358500      -3.135800       1.382200    
 H    6.425200     -0.8273000      -2.081000    
 H   -1.243900     -0.1768000      -1.019100    
 H    6.884700      -2.703100     -0.5245000    
 H   -3.398600      -1.030900      -1.665400    
 H   -3.083000       1.213300       2.006000    
 H   -5.489500      0.9146000       2.393200    
 H   -6.862700     -0.3134000      0.8287000    
 H   -7.530900      -2.160800     -0.2220000    
 H   -7.815300      -2.177400      -1.959100    
 H   -7.870000     -0.6237000      -1.133700    


%chk=000051032-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000051032

0 1
O 0.997221 -1.461314 0.148458
O -6.040959 -2.254996 -0.027496
N 2.604397 1.712914 -0.027063
N 2.637655 0.288467 0.119922
N -0.957184 1.060075 -0.079132
C 1.260447 2.098783 -0.034767
C 0.432266 0.971510 0.002548
C 1.288233 -0.228139 0.109265
C 3.812326 -0.451212 -0.219007
C 3.642466 2.491102 0.682734
C 0.837212 3.534375 -0.056233
C 4.022749 -1.712980 0.392459
C 4.737990 0.044455 -1.174271
C 5.164965 -2.466411 0.049007
C 5.886434 -0.711462 -1.491072
C -1.726779 -0.010197 -0.009613
C -3.191504 0.099790 -0.103509
C 6.106664 -1.968728 -0.881925
C -3.969885 -1.081418 -0.026987
C -3.844098 1.357691 -0.270024
C -5.380666 -1.017214 -0.115594
C -5.244826 1.409726 -0.356139
C -6.030625 0.230567 -0.280907
C -7.502023 -2.249661 -0.118261
H 4.642151 2.125425 0.404362
H 3.524672 2.417209 1.781572
H 3.553800 3.544182 0.374046
H -0.256778 3.553499 -0.184644
H 1.307060 4.091199 -0.887707
H 1.081654 4.060111 0.886806
H 3.288273 -2.094097 1.105468
H 4.536415 0.992066 -1.685317
H 5.321194 -3.444545 0.516776
H 6.599065 -0.325617 -2.228557
H -1.306468 -1.023667 0.117273
H 6.995419 -2.556284 -1.135747
H -3.494542 -2.060513 0.099993
H -3.229144 2.260125 -0.328517
H -5.748942 2.374561 -0.484629
H -7.120285 0.298786 -0.351303
H -7.956321 -1.666117 0.706563
H -7.798354 -3.305387 -0.031633
H -7.845348 -1.844761 -1.090598


