%chk=000046900.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000046900

2 1
 O  -1.9000000E-03  9.0200000E-02 -9.9999997E-05
 N    4.862600     -0.1822000      1.9000000E-03
 N   -4.836100     -0.1623000     -1.0000000E-03
 C    3.681500      0.7768000     -3.8300000E-02
 C   -3.686500      0.7731000      3.8300000E-02
 C    2.390100     -2.2800000E-02 -1.5000000E-02
 C   -2.394200     -2.5200000E-02  1.4800000E-02
 C    4.791700      -1.124800      -1.190900    
 C    6.161000      0.6099000     -5.4099999E-02
 C    4.816600     -0.9904000       1.290600    
 C   -4.819500     -0.9951000      -1.290800    
 C   -4.794300      -1.129600       1.190700    
 C   -6.166000      0.6033000      5.3900000E-02
 C    1.172500      0.8900000     -7.3000002E-03
 C   -1.177600      0.8890000      7.3000002E-03
 H    3.761300       1.442200      0.8293000    
 H    3.765900       1.374700     -0.9534000    
 H   -3.758000       1.442600     -0.8272000    
 H   -3.762500       1.375200      0.9516000    
 H    2.306300     -0.6670000      0.8653000    
 H    2.289900     -0.6753000     -0.8883000    
 H   -2.308700     -0.6691000     -0.8656000    
 H   -2.292300     -0.6775000      0.8883000    
 H    4.636200     -0.5343000      -2.098600    
 H    5.745400      -1.659200      -1.254600    
 H    3.994600      -1.858600      -1.048200    
 H    6.192600       1.281600      0.8090000    
 H    7.001000     -9.0300001E-02 -2.2800000E-02
 H    6.176600       1.181800     -0.9866000    
 H    4.675400     -0.3056000       2.132000    
 H    4.020300      -1.736700       1.244200    
 H    5.773300      -1.513000       1.394200    
 H   -5.778900      -1.516700      -1.369300    
 H   -4.690800     -0.3169000      -2.139300    
 H   -4.021400      -1.739700      -1.248100    
 H   -5.751500      -1.659700       1.230000    
 H   -3.995900      -1.862400       1.051300    
 H   -4.650400     -0.5467000       2.104900    
 H   -6.989600     -0.1159000      2.1800000E-02
 H   -6.190500       1.174300      0.9867000    
 H   -6.206900       1.273900     -0.8093000    
 H    1.175800       1.528000     -0.8991000    
 H    1.187100       1.528400      0.8840000    
 H   -1.181200       1.526800      0.8992000    
 H   -1.192600       1.527500     -0.8839000    


%chk=000046900-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000046900

2 1
O -0.001568 0.089603 0.000734
N 5.013297 -0.202691 -0.000634
N -5.016316 -0.207885 0.000379
C 3.731762 0.672618 -0.000605
C -3.735388 0.668988 0.000507
C 2.397580 -0.094092 -0.000408
C -2.400552 -0.096339 0.002097
C 5.074891 -1.084150 -1.248804
C 6.222515 0.740666 -0.002008
C 5.076176 -1.082304 1.248735
C -5.078468 -1.086881 -1.249431
C -5.076826 -1.090101 1.248042
C -6.226384 0.734287 0.002426
C 1.220976 0.902944 -0.000267
C -1.224834 0.901828 -0.000330
H 3.812444 1.316937 0.893606
H 3.812264 1.316680 -0.895019
H -3.816387 1.312197 -0.894462
H -3.817545 1.313793 0.894224
H 2.292807 -0.734521 0.893043
H 2.292653 -0.734576 -0.893799
H -2.294996 -0.738733 -0.889861
H -2.294997 -0.734577 0.897003
H 4.987532 -0.449195 -2.143668
H 6.040425 -1.612434 -1.261385
H 4.257027 -1.817606 -1.223806
H 6.189102 1.372908 0.898361
H 7.146089 0.142412 -0.001369
H 6.188812 1.370595 -0.903982
H 4.990064 -0.446069 2.142806
H 4.258072 -1.815561 1.225804
H 6.041556 -1.610876 1.260910
H -6.042927 -1.617142 -1.261293
H -4.994014 -0.450020 -2.143214
H -4.259093 -1.818755 -1.227437
H -6.042400 -1.618308 1.261113
H -4.259060 -1.823629 1.221878
H -4.988640 -0.455757 2.143263
H -7.149392 0.135162 0.000191
H -6.193910 1.362819 0.905419
H -6.192968 1.368007 -0.896909
H 1.248077 1.553178 -0.902346
H 1.248927 1.554011 0.901184
H -1.252655 1.554200 0.900174
H -1.253326 1.550669 -0.903364


