%chk=000126269.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000126269

0 1
 I   -5.431800       2.359300      0.5751000    
 O    3.667100      0.3771000      -1.771300    
 N   0.5724000       2.538000     -0.1789000    
 N   -4.540900     -0.5803000      0.1769000    
 N    4.425400     -0.4571000      0.2615000    
 C  -0.4658000       1.512200     -0.4800000    
 C  -4.8000002E-03  6.1500002E-02 -0.1459000    
 C   -1.812400       1.909800      0.2316000    
 C    2.337700      0.8433000      0.1227000    
 C    1.897000       2.095700     -0.6387000    
 C   -2.793200      0.7933000      0.1786000    
 C   -1.032100      -1.004100     -0.1548000    
 C   -2.339800     -0.5302000      1.6000000E-03
 C    1.275400     -0.2118000      0.1613000    
 C   -3.432600      -1.381200      6.0000001E-03
 C   -4.163100      0.7408000      0.2850000    
 C   0.2593000       3.838300     -0.7806000    
 C    3.530600      0.2381000     -0.5530000    
 C  -0.8664000      -2.386100     -0.3077000    
 C   -3.284800      -2.760900     -0.1441000    
 C   -1.976100      -3.243400     -0.3007000    
 C   -5.901700      -1.074000      0.2370000    
 C    5.625600      -1.094000     -0.2654000    
 C    4.224300     -0.5973000       1.701400    
 C    5.356700      -2.525000     -0.6830000    
 C    4.873800      0.5380000       2.465400    
 H  -0.6536000       1.510600      -1.565700    
 H   -2.241400       2.793500     -0.2522000    
 H   -1.620500       2.159500       1.283300    
 H    2.556200       1.160800       1.144100    
 H    2.643900       2.880600     -0.4576000    
 H    1.870800       1.936300      -1.725700    
 H    1.568900      -1.220800      0.4376000    
 H    1.058600       4.560000     -0.5749000    
 H  -0.6463000       4.273400     -0.3481000    
 H   0.1327000       3.770800      -1.867000    
 H   0.1217000      -2.817400     -0.4455000    
 H   -4.126300      -3.443600     -0.1430000    
 H   -1.819200      -4.312900     -0.4235000    
 H   -6.312000     -0.8341000       1.221400    
 H   -6.480200     -0.5921000     -0.5555000    
 H   -5.930300      -2.154400      8.9599997E-02
 H    5.961000     -0.5290000      -1.142600    
 H    6.427300      -1.046700      0.4792000    
 H    3.168000     -0.6639000       1.965200    
 H    4.661900      -1.550000       2.023300    
 H    5.028200      -3.132300      0.1666000    
 H    4.573400      -2.572400      -1.447000    
 H    6.263200      -2.978600      -1.095400    
 H    5.957700      0.5469000       2.309000    
 H    4.494200       1.516400       2.156800    
 H    4.691900      0.4254000       3.538900    


%chk=000126269-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000126269

0 1
I -5.579311 2.357077 0.622457
O 3.934035 0.373677 -1.774130
N 0.558028 2.513853 -0.289853
N -4.672722 -0.586060 0.198735
N 4.499569 -0.438736 0.326351
C -0.515969 1.506102 -0.506052
C -0.031875 0.081610 -0.151603
C -1.806509 1.918970 0.288308
C 2.369179 0.867914 0.061754
C 1.877188 2.050789 -0.794111
C -2.838235 0.827758 0.207693
C -1.076595 -0.972841 -0.158934
C -2.409121 -0.524535 0.000256
C 1.274077 -0.183556 0.135014
C -3.537466 -1.394869 0.001812
C -4.223718 0.758153 0.318442
C 0.214913 3.843456 -0.840144
C 3.658850 0.259984 -0.535357
C -0.902305 -2.366729 -0.328873
C -3.358043 -2.788237 -0.160449
C -2.026821 -3.244187 -0.322498
C -6.060386 -1.048508 0.252403
C 5.721738 -1.059543 -0.245059
C 4.285691 -0.598675 1.783956
C 5.477815 -2.508835 -0.716465
C 5.011829 0.475531 2.625288
H -0.808640 1.473681 -1.592151
H -2.207849 2.867482 -0.111172
H -1.506408 2.107990 1.338583
H 2.577693 1.254384 1.079786
H 2.590352 2.890720 -0.715975
H 1.850039 1.737212 -1.862604
H 1.566480 -1.208190 0.403306
H 1.063104 4.530705 -0.676174
H -0.660061 4.269966 -0.322565
H -0.005120 3.821589 -1.937558
H 0.096004 -2.784560 -0.499184
H -4.191123 -3.498664 -0.170302
H -1.855631 -4.317638 -0.463020
H -6.540554 -0.755537 1.203104
H -6.654559 -0.637443 -0.583872
H -6.069498 -2.147200 0.181245
H 6.039714 -0.441662 -1.101524
H 6.515879 -1.027280 0.524497
H 3.206886 -0.589877 2.010314
H 4.653840 -1.603571 2.067198
H 5.128568 -3.152779 0.112127
H 4.717887 -2.521238 -1.516028
H 6.410811 -2.945470 -1.118095
H 6.096846 0.477430 2.416955
H 4.621446 1.484186 2.400890
H 4.869658 0.282201 3.704581


