%chk=000105653.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000105653

0 1
 O    3.597000       1.830200      -1.052800    
 O    2.500000       1.903500      0.9697000    
 N    1.070100     -0.4286000       1.292700    
 C   -3.313700       1.818200      0.9920000    
 C   -4.608500       1.360300      0.3075000    
 C   -2.066700       1.158500      0.4382000    
 C   -4.837800     -0.1206000      0.4324000    
 C   -5.059300      -1.012700     -0.5515000    
 C   -1.801200       1.435400      -1.020600    
 C   -1.205200      0.3928000       1.132000    
 C   -5.273800      -2.466800     -0.2254000    
 C   -5.099500     -0.6942000      -2.018800    
 C   1.7700000E-02 -0.2189000      0.5678000    
 C    2.168800     -0.9969000      0.6254000    
 C    3.128000     -0.1906000      1.8100001E-02
 C    2.284500      -2.383900      0.5792000    
 C    4.210100     -0.7751000     -0.6398000    
 C    3.366700      -2.968400     -7.8800000E-02
 C    4.329500      -2.164000     -0.6883000    
 C    3.029200       1.262800      5.4000001E-02
 C    3.564100       3.259200      -1.133100    
 H   -3.216800       2.906300      0.8899000    
 H   -3.387300       1.620500       2.069500    
 H   -4.612400       1.701400     -0.7305000    
 H   -5.450400       1.870100      0.7927000    
 H   -4.840200     -0.4854000       1.459200    
 H  -0.7359000       1.463300      -1.268800    
 H   -2.190700       2.421400      -1.299000    
 H   -2.293100      0.6875000      -1.649700    
 H   -1.358900      0.2408000       2.196700    
 H   -4.505700      -3.080400     -0.7075000    
 H   -5.229400      -2.665200      0.8506000    
 H   -6.255700      -2.794100     -0.5827000    
 H   -4.312700      -1.247100      -2.543200    
 H   -6.065900     -0.9920000      -2.439600    
 H   -4.961300      0.3634000      -2.248500    
 H  -5.1000002E-03 -0.4649000     -0.5088000    
 H    1.540200      -3.019400       1.051800    
 H    4.985500     -0.1778000      -1.112300    
 H    3.460200      -4.049900     -0.1156000    
 H    5.173800      -2.619500      -1.197500    
 H    4.111300       3.696700     -0.2929000    
 H    2.528600       3.612200      -1.145900    
 H    4.050300       3.559200      -2.065100    


%chk=000105653-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000105653

0 1
O 4.363717 1.892626 -0.501985
O 2.044157 1.887118 -0.594173
N 1.003992 -0.540893 0.882175
C -3.359321 1.683657 1.048612
C -4.741903 1.197770 0.509215
C -2.164947 1.226024 0.224904
C -4.867793 -0.312812 0.498183
C -5.362100 -1.111858 -0.491215
C -2.205668 1.575362 -1.249683
C -1.132698 0.552568 0.833423
C -5.417083 -2.622070 -0.316604
C -5.902104 -0.611398 -1.820523
C 0.075498 0.066233 0.181465
C 2.226217 -1.022190 0.374603
C 3.274786 -0.215986 -0.199162
C 2.486449 -2.409806 0.589422
C 4.520999 -0.826473 -0.524896
C 3.706242 -2.997310 0.217611
C 4.738800 -2.201862 -0.342208
C 3.115390 1.244263 -0.440441
C 4.304583 3.343317 -0.784128
H -3.376473 2.794625 1.068893
H -3.241359 1.345405 2.095652
H -4.922308 1.623029 -0.494635
H -5.520795 1.633059 1.170686
H -4.511037 -0.806289 1.416778
H -1.231545 1.460051 -1.749298
H -2.534845 2.623257 -1.387913
H -2.940424 0.935466 -1.777031
H -1.182702 0.352520 1.911895
H -4.834244 -3.135059 -1.107661
H -5.015615 -2.936461 0.662256
H -6.457751 -2.995023 -0.398445
H -5.384934 -1.109773 -2.664505
H -6.977554 -0.860150 -1.920964
H -5.799403 0.478571 -1.951082
H 0.173110 0.197488 -0.908739
H 1.697288 -3.001783 1.063555
H 5.311401 -0.190529 -0.932347
H 3.862056 -4.070145 0.378222
H 5.698851 -2.649607 -0.618450
H 3.735052 3.864221 0.003864
H 3.819899 3.529122 -1.758058
H 5.354519 3.669026 -0.794568


