%chk=000108117.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000108117

0 1
 I    7.296100      0.3678000      0.6415000    
 O   -3.909600     -0.8004000     -0.3970000    
 O   -2.842300       2.584700     -0.5338000    
 O   -3.855200     -0.6446000       1.916200    
 N   -2.931600      0.2440000     -0.4356000    
 C    1.785300       1.519900      0.6933000    
 C   0.6598000      0.6700000      0.1415000    
 C    1.170300     -0.5198000     -0.4246000    
 C    2.998200      0.6713000      0.3737000    
 C    2.610300     -0.5190000     -0.2815000    
 C  -0.6967000      0.9433000      0.1486000    
 C   0.3170000      -1.451300     -0.9922000    
 C   -1.556600      4.1000000E-03 -0.4235000    
 C    4.326500      0.9461000      0.6475000    
 C    3.559500      -1.449600     -0.6700000    
 C   -1.054900      -1.181200     -0.9882000    
 C    5.283100      7.7999998E-03  0.2559000    
 C    4.903500      -1.178100     -0.3962000    
 C   -3.488400       1.537100     -0.4870000    
 C   -4.999900       1.623300     -0.4934000    
 C   -4.276300      -1.140100      0.8796000    
 C   -5.298000      -2.235100      0.8253000    
 H    1.836400       2.480500      0.1728000    
 H    1.677800       1.650800       1.773900    
 H   -1.034700       1.843400      0.6472000    
 H   0.6895000      -2.370000      -1.432700    
 H    4.599500       1.867500       1.151900    
 H    3.281700      -2.369100      -1.174100    
 H   -1.728600      -1.908000      -1.437000    
 H    5.651000      -1.907700     -0.7004000    
 H   -5.302400       2.646600     -0.7373000    
 H   -5.394700       1.375100      0.4945000    
 H   -5.425200      0.9599000      -1.251000    
 H   -5.587600      -2.511400       1.843200    
 H   -6.186400      -1.886400      0.2928000    
 H   -4.873600      -3.114100      0.3336000    


%chk=000108117-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000108117

0 1
I 7.440751 0.175378 0.540461
O -3.888260 -0.675759 -0.474318
O -2.994182 2.815977 -0.303595
O -3.973554 -0.710719 1.892978
N -3.020449 0.494720 -0.367527
C 1.883633 1.638615 0.526928
C 0.686285 0.797891 0.097886
C 1.124753 -0.488145 -0.340023
C 3.058839 0.695911 0.293014
C 2.590641 -0.553368 -0.219031
C -0.669672 1.151165 0.101941
C 0.178209 -1.433117 -0.790080
C -1.617413 0.189889 -0.352156
C 4.429080 0.918358 0.513851
C 3.505067 -1.588595 -0.512651
C -1.188772 -1.090994 -0.801454
C 5.330160 -0.131579 0.213506
C 4.886521 -1.375617 -0.294417
C -3.667396 1.746787 -0.338209
C -5.187276 1.719350 -0.355590
C -4.265879 -1.239557 0.815354
C -5.027350 -2.516000 0.557718
H 1.970244 2.565344 -0.073024
H 1.810199 1.954076 1.585831
H -1.006430 2.136857 0.424006
H 0.489418 -2.423322 -1.140140
H 4.791553 1.873473 0.905563
H 3.165119 -2.552988 -0.905594
H -1.928064 -1.806309 -1.170094
H 5.606491 -2.168132 -0.517032
H -5.534135 2.757691 -0.460004
H -5.583392 1.307868 0.590549
H -5.578997 1.107967 -1.185742
H -5.837942 -2.617586 1.296438
H -5.432564 -2.544126 -0.464761
H -4.342436 -3.374102 0.686917


