%chk=000167295.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000167295

0 1
 O   -1.455000      -2.415300       1.639700    
 O   -1.976600      -2.206800     -0.4825000    
 N  -0.9326000      0.3571000      0.6514000    
 N   -4.370400      0.8472000     -0.6016000    
 N    3.117900      4.5800000E-02 -0.3779000    
 N   -1.131600      -2.283000      0.4378000    
 C   0.4375000      0.2193000      0.2989000    
 C    1.006400      -1.030800      3.5599999E-02
 C    1.210100       1.382600      0.2236000    
 C   -1.957700      0.5468000     -0.3192000    
 C   -3.311300      0.6255000      0.3750000    
 C    2.369300      -1.071600     -0.3039000    
 C    2.565000       1.247400     -0.1232000    
 C   0.2535000      -2.216100      0.1039000    
 C   0.6644000       2.651900      0.4833000    
 C    2.941600      -2.313300     -0.5670000    
 C    3.339500       2.401900     -0.1998000    
 C   0.8495000      -3.444800     -0.1638000    
 C    2.196400      -3.493100     -0.5001000    
 C    1.460200       3.790500      0.3999000    
 C    2.800500       3.664900      5.7599999E-02
 C   -4.409100       2.252500      -1.010600    
 C   -5.667600      0.4415000     -5.7300001E-02
 H   -1.761500       1.512700     -0.8005000    
 H   -1.938000     -0.1527000      -1.155900    
 H   -1.071800      0.8114000       1.550600    
 H   -3.474900     -0.3284000      0.8934000    
 H   -3.314200       1.395900       1.158300    
 H  -0.3763000       2.795800      0.7598000    
 H    3.995300      -2.377500     -0.8327000    
 H    4.392500       2.329800     -0.4661000    
 H   0.2836000      -4.372100     -0.1161000    
 H    2.671500      -4.446600     -0.7111000    
 H    1.037100       4.769600      0.6023000    
 H    3.430400       4.547000     -9.8999999E-03
 H   -3.490600       2.554700      -1.522200    
 H   -4.573800       2.927800     -0.1628000    
 H   -5.218400       2.414800      -1.732300    
 H   -5.665400     -0.6257000      0.1918000    
 H   -6.459600      0.5850000     -0.8008000    
 H   -5.932200       1.007300      0.8434000    


%chk=000167295-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000167295

0 1
O -1.325733 -0.941084 1.905296
O -2.317533 -2.520330 0.585001
N -0.852767 1.273760 0.107083
N -4.489579 0.414173 -0.595412
N 3.148928 -0.009488 -0.494006
N -1.324060 -1.737101 0.883523
C 0.422131 0.756355 0.148372
C 0.757184 -0.629767 -0.089692
C 1.531987 1.664416 0.391444
C -2.036903 0.762822 -0.617084
C -3.332522 0.813762 0.230331
C 2.126689 -0.915351 -0.523310
C 2.872601 1.224983 0.045200
C -0.111885 -1.775791 0.036632
C 1.362547 2.989101 0.913371
C 2.445941 -2.227545 -1.028796
C 3.971516 2.134266 0.222238
C 0.228890 -3.044926 -0.439381
C 1.510953 -3.258371 -1.027398
C 2.452729 3.843554 1.092208
C 3.771165 3.413634 0.735286
C -5.163154 1.538155 -1.267857
C -5.425262 -0.516424 0.067120
H -2.181277 1.379373 -1.529072
H -1.868946 -0.264154 -0.967692
H -0.933557 2.257625 0.370526
H -3.224721 0.130760 1.089434
H -3.457657 1.841609 0.655268
H 0.375429 3.344840 1.235826
H 3.469349 -2.371867 -1.387594
H 4.964553 1.768789 -0.055947
H -0.475574 -3.868479 -0.295025
H 1.771948 -4.250158 -1.408921
H 2.300842 4.842177 1.515224
H 4.619750 4.092248 0.873590
H -4.428253 2.151546 -1.820441
H -5.711030 2.212892 -0.560816
H -5.892858 1.152081 -2.002351
H -4.862283 -1.371033 0.478578
H -6.143872 -0.906893 -0.676778
H -6.012110 -0.045259 0.895019


