%chk=000098159.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000098159

0 1
 O   -2.935900       1.434500      6.8499997E-02
 N   -1.705700     -0.5592000     -0.1388000    
 N   -5.152000      0.1944000     -0.8278000    
 C    1.998300     -0.6427000     -7.8400001E-02
 C    2.288700      0.7338000      7.7200003E-02
 C  -0.3798000     -0.1303000     -6.7400001E-02
 C   0.6587000      -1.058400     -0.1489000    
 C   -4.134200     -0.6391000     -0.1924000    
 C    1.230800       1.653800      0.1577000    
 C  -9.4200000E-02   1.223200      8.5600004E-02
 C   -2.875200      0.2166000     -7.5700000E-02
 C    3.056200      -1.562900     -0.1587000    
 C    3.628400       1.149400      0.1480000    
 C   -4.632200      -1.102200       1.171700    
 C    4.381300      -1.132200     -8.6800002E-02
 C    4.666900      0.2214000      6.6200003E-02
 H   0.4270000      -2.115900     -0.2685000    
 H   -3.937600      -1.503500     -0.8357000    
 H    1.432000       2.716500      0.2772000    
 H  -0.8412000       2.001100      0.1553000    
 H   -1.828500      -1.563600     -0.2472000    
 H    2.856800      -2.625800     -0.2783000    
 H    3.875000       2.202400      0.2676000    
 H   -4.824900     -0.2550000       1.840100    
 H   -5.554600      -1.685900       1.081200    
 H   -3.880700      -1.733100       1.659000    
 H    5.190200      -1.854100     -0.1502000    
 H    5.698700      0.5559000      0.1222000    
 H   -5.394600      0.9738000     -0.2162000    
 H   -6.010100     -0.3442000     -0.9427000    


%chk=000098159-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000098159

0 1
O -3.020284 1.451204 -0.025462
N -1.758824 -0.528615 -0.199938
N -5.283007 0.118022 -0.803456
C 1.986483 -0.633575 -0.076288
C 2.312763 0.768593 0.092769
C -0.414389 -0.067304 -0.095631
C 0.613908 -1.020224 -0.166715
C -4.218097 -0.688929 -0.203435
C 1.238974 1.715441 0.162411
C -0.095526 1.325024 0.071674
C -2.946767 0.191323 -0.146092
C 3.055207 -1.589537 -0.148341
C 3.688621 1.159604 0.182496
C -4.543227 -1.202704 1.235699
C 4.386739 -1.178335 -0.058092
C 4.708332 0.207475 0.108755
H 0.373742 -2.084596 -0.295437
H -4.006765 -1.574136 -0.843375
H 1.479812 2.777669 0.288968
H -0.909945 2.049519 0.119617
H -1.863687 -1.536883 -0.341687
H 2.812091 -2.651319 -0.276976
H 3.929626 2.221740 0.310230
H -4.689901 -0.346846 1.918311
H -5.474638 -1.798382 1.216162
H -3.739120 -1.844661 1.643819
H 5.194669 -1.916193 -0.115173
H 5.757445 0.514893 0.177802
H -5.133116 1.125192 -0.673288
H -6.233522 -0.194760 -0.595531


