%chk=000085838.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000085838

0 1
 O   -1.011400      -2.245100      0.1238000    
 N    2.344200      0.2999000      0.1434000    
 C  -3.7200000E-02 -5.6200001E-02 -0.2462000    
 C  -0.3901000       1.214700      0.5327000    
 C   -1.742600       1.784100      0.1067000    
 C   -2.852000      0.7511000      0.2851000    
 C    1.276700     -0.6481000      0.2541000    
 C   -2.559600     -0.5271000     -0.4870000    
 C   -1.184600      -1.055800     -0.1384000    
 C    2.550400      0.7227000      -1.252900    
 C    3.606100     -0.2403000      0.6786000    
 H   2.0199999E-02  0.1670000      -1.318800    
 H   0.3659000       1.994000      0.3857000    
 H  -0.4214000      0.9985000       1.608800    
 H   -1.697100       2.103500     -0.9416000    
 H   -1.971000       2.673500      0.7048000    
 H   -3.807100       1.172600     -4.7600001E-02
 H   -2.957500      0.5179000       1.352100    
 H    1.502200      -1.568800     -0.3021000    
 H    1.149800     -0.9518000       1.302400    
 H   -2.592600     -0.3497000      -1.567400    
 H   -3.308800      -1.288000     -0.2447000    
 H    2.678700     -0.1309000      -1.928300    
 H    3.447600       1.349000      -1.330600    
 H    1.734600       1.352600      -1.619200    
 H    3.483200     -0.5266000       1.729100    
 H    4.393300      0.5212000      0.6508000    
 H    3.947400      -1.117500      0.1172000    


%chk=000085838-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000085838

0 1
O -1.045346 -2.250087 0.230215
N 2.403993 0.297120 0.002945
C -0.080364 -0.043831 -0.262290
C -0.431793 1.208434 0.600079
C -1.799532 1.808812 0.207973
C -2.928259 0.760036 0.338674
C 1.280334 -0.665476 0.116654
C -2.611618 -0.517509 -0.493429
C -1.223951 -1.060873 -0.152067
C 2.739938 0.627610 -1.396545
C 3.593821 -0.152222 0.755066
H -0.065037 0.291959 -1.322809
H 0.387585 1.940691 0.489781
H -0.448309 0.909553 1.668610
H -1.756740 2.175986 -0.838744
H -2.024058 2.686288 0.844434
H -3.896382 1.181875 0.008463
H -3.045329 0.476757 1.403660
H 1.451517 -1.581856 -0.501661
H 1.223881 -1.008391 1.166399
H -2.631609 -0.252802 -1.571113
H -3.359237 -1.310743 -0.320406
H 3.058999 -0.265587 -1.993380
H 3.563418 1.363848 -1.415059
H 1.873516 1.084838 -1.906236
H 3.327153 -0.307640 1.815432
H 4.377500 0.625746 0.709720
H 4.033208 -1.106136 0.366134


