%chk=000088571.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000088571

0 1
 O    1.200400      -1.359000      0.3860000    
 O    5.562700     -0.6612000      -1.158300    
 N    1.590600      0.8686000      0.3685000    
 N    3.383900     -0.7057000      0.6753000    
 C   1.1500000E-02 -0.7221000      0.1958000    
 C   0.2571000      0.6246000      0.1868000    
 C   -1.137300      -1.570200      5.9900001E-02
 C  -0.7281000       1.655200      1.2900000E-02
 C    2.096600     -0.3387000      0.4802000    
 C    4.492800      0.2218000      0.8025000    
 C   -2.396900      -1.125800      0.4763000    
 C   -1.007600      -2.850100     -0.4896000    
 C   -1.376600       2.194600       1.123800    
 C   -1.036100       2.116800      -1.266700    
 C    5.068600      0.5345000     -0.5681000    
 C   -3.513400      -1.951500      0.3449000    
 C   -2.124100      -3.676000     -0.6212000    
 C   -2.333300       3.195600      0.9550000    
 C   -1.992600       3.118000      -1.435500    
 C   -3.377000      -3.226600     -0.2039000    
 C   -2.641300       3.657200     -0.3246000    
 H    3.619100      -1.693400      0.7283000    
 H    5.260900     -0.2539000       1.422600    
 H    4.181200       1.141300       1.310600    
 H   -2.549600     -0.1594000      0.9393000    
 H  -4.4700000E-02  -3.224300     -0.8300000    
 H   -1.146500       1.847500       2.128600    
 H  -0.5395000       1.706900      -2.143100    
 H    5.902200       1.237400     -0.4795000    
 H    4.320200      0.9700000      -1.238100    
 H   -4.487900      -1.605200      0.6767000    
 H   -2.018500      -4.668300      -1.049700    
 H   -2.838200       3.615800       1.820000    
 H   -2.232600       3.477500      -2.431900    
 H   -4.245900      -3.870100     -0.3049000    
 H   -3.386200       4.436600     -0.4561000    
 H    4.813600      -1.275500      -1.242900    


%chk=000088571-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000088571

0 1
O 1.163927 -1.584474 0.242839
O 5.531347 0.110522 -1.092983
N 1.545355 0.668158 0.492029
N 3.381129 -0.911527 0.736076
C -0.099068 -0.901094 0.049838
C 0.165500 0.465418 0.178815
C -1.254313 -1.779002 -0.131328
C -0.697518 1.647233 -0.007536
C 2.078430 -0.549194 0.511523
C 4.391448 0.095419 1.119423
C -2.561145 -1.377861 0.271334
C -1.081441 -3.083249 -0.679641
C -0.361480 2.855283 0.663836
C -1.821099 1.640674 -0.879668
C 4.857323 0.937511 -0.084533
C -3.659138 -2.245624 0.105498
C -2.183304 -3.948514 -0.837322
C -1.146895 4.014348 0.494398
C -2.602463 2.802531 -1.050017
C -3.479956 -3.534160 -0.452492
C -2.275024 3.993423 -0.358999
H 3.582116 -1.904728 0.840713
H 5.256715 -0.447160 1.538088
H 3.977085 0.764277 1.898992
H -2.709984 -0.396760 0.732743
H -0.079768 -3.408058 -0.978258
H 0.523664 2.866589 1.307280
H -2.068788 0.735041 -1.442936
H 5.615654 1.665883 0.246864
H 3.995563 1.484799 -0.514168
H -4.655502 -1.920609 0.425356
H -2.030718 -4.946544 -1.263239
H -0.877358 4.935250 1.023707
H -3.460492 2.782088 -1.731384
H -4.335757 -4.206489 -0.577370
H -2.884105 4.894341 -0.492938
H 4.867560 -0.530842 -1.454636


