%chk=000048880.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000048880

0 1
 O    3.467000       1.085500      4.1999999E-03
 O    1.588200       2.380900     -0.2372000    
 N  -0.3518000      -1.409000      0.3401000    
 N  -0.7712000      0.8903000     -1.5799999E-02
 N    1.457700      7.3299997E-02  0.1323000    
 N   -4.286500     -0.1210000     -0.5006000    
 C   0.5740000      -2.514900      0.5168000    
 C    1.416500      -2.677600     -0.7644000    
 C    1.428700      -2.217100       1.750400    
 C  -0.2559000      -3.781500      0.7559000    
 C   0.6160000      -2.976100      -2.027100    
 C   7.0900001E-02 -0.1985000      0.1524000    
 C   -2.181800      0.9556000     -2.8600000E-02
 C    2.116600       1.290100     -5.2499998E-02
 C   -2.842300       2.098500      0.3947000    
 C   -2.935200     -0.1178000     -0.4631000    
 C   -4.232100       2.133400      0.3708000    
 C    4.282800       2.249700     -0.1685000    
 C   -4.901500       1.007800     -8.1600003E-02
 C    5.739700       1.848700     -7.8400001E-02
 H    2.088400      -1.859700      -1.019300    
 H    2.094900      -3.528900     -0.6074000    
 H    1.459000      -3.093900       2.411300    
 H    2.483900      -2.033200       1.520500    
 H    1.045700      -1.398500       2.370400    
 H   -1.014100      -3.931600     -2.0099999E-02
 H  -0.8034000      -3.712700       1.704000    
 H   0.3768000      -4.674700      0.7994000    
 H   9.3099996E-02  -3.934400      -1.964300    
 H  -0.1146000      -2.189500      -2.237700    
 H    1.291700      -3.038100      -2.887200    
 H  -0.3391000       1.809900     -1.3700000E-02
 H    2.123700     -0.6579000      0.3051000    
 H   -2.290800       2.966400      0.7455000    
 H   -2.494200      -1.032300     -0.8426000    
 H   -4.774300       3.013700      0.6963000    
 H    4.050000       2.978000      0.6163000    
 H    4.081100       2.694000      -1.149600    
 H   -5.985500      0.9842000     -0.1197000    
 H    5.983200       1.106300     -0.8456000    
 H    5.952600       1.385600      0.8908000    
 H    6.392900       2.716300     -0.2064000    


%chk=000048880-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000048880

0 1
O 3.506729 1.288020 0.002142
O 1.494373 2.490895 -0.138654
N -0.272895 -1.458635 0.375376
N -0.687203 0.865014 0.103717
N 1.559713 0.141042 0.160603
N -4.317590 -0.131502 0.195348
C 0.538381 -2.705445 0.499008
C 1.420991 -2.989506 -0.767367
C 1.431723 -2.685993 1.778643
C -0.501003 -3.846135 0.671203
C 0.660060 -2.989729 -2.110210
C 0.157804 -0.242792 0.222398
C -2.097104 0.902811 0.088045
C 2.117548 1.397607 -0.005865
C -2.707993 2.179242 -0.076649
C -2.956424 -0.229667 0.223372
C -4.110879 2.278341 -0.103063
C 4.259995 2.570923 -0.148999
C -4.881727 1.100269 0.034423
C 5.741297 2.216647 -0.084929
H 2.253725 -2.258098 -0.832567
H 1.901879 -3.975179 -0.610968
H 1.838506 -3.695842 1.965742
H 2.292328 -1.992709 1.715591
H 0.825643 -2.390186 2.653525
H -1.220384 -3.842695 -0.164185
H -1.073705 -3.692876 1.602219
H -0.004400 -4.832945 0.715330
H -0.090332 -3.798420 -2.150514
H 0.128781 -2.034477 -2.266553
H 1.359356 -3.138031 -2.952785
H -0.196493 1.769031 -0.009803
H 2.228864 -0.621800 0.262396
H -2.083640 3.074825 -0.183404
H -2.521163 -1.220507 0.355500
H -4.600283 3.249200 -0.231951
H 3.950891 3.252275 0.663788
H 3.974435 3.028302 -1.113130
H -5.976828 1.132580 0.018395
H 6.016833 1.520581 -0.894995
H 5.995100 1.749927 0.881737
H 6.345893 3.134938 -0.196109


