%chk=000022506.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000022506

0 1
 O   0.9657000       2.539500     -0.1638000    
 N   0.1175000      0.6338000      0.1690000    
 N   0.3232000       1.620900     -0.6822000    
 C    1.182700     -0.4299000      0.1782000    
 C   -1.308300      0.1553000      0.1713000    
 C   0.8956000      -1.525400     -0.8788000    
 C   -1.540300     -0.9507000     -0.8863000    
 C  -0.5214000      -2.080100     -0.8131000    
 C    1.321000      -1.058400       1.587500    
 C    2.613000      0.1245000     -0.1211000    
 C   -2.318100       1.309500     -0.1374000    
 C   -1.730500     -0.3390000       1.576900    
 H    1.606500      -2.354300     -0.7686000    
 H    1.056700      -1.114800      -1.885100    
 H   -1.495400     -0.5127000      -1.893000    
 H   -2.548200      -1.371900     -0.7803000    
 H  -0.6814000      -2.769000      -1.650900    
 H  -0.6633000      -2.669900      9.7900003E-02
 H   0.5501000      -1.792100       1.817900    
 H    2.268700      -1.602900       1.686500    
 H    1.314600     -0.2873000       2.366500    
 H    2.686500      0.5592000      -1.124600    
 H    2.907400      0.8866000      0.6098000    
 H    3.362600     -0.6753000     -7.7500001E-02
 H   -2.198700       1.708200      -1.151600    
 H   -3.354100      0.9552000     -6.8800002E-02
 H   -2.206500       2.136500      0.5742000    
 H   -2.822900     -0.3972000       1.664100    
 H   -1.375300      -1.340800       1.813900    
 H   -1.385100      0.3482000       2.357900    


%chk=000022506-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000022506

0 1
O 1.331319 2.051105 1.366661
N 0.057561 0.494314 0.287855
N 0.161854 1.709678 0.940631
C 1.240900 -0.464175 0.130376
C -1.416479 0.125198 0.107541
C 0.858157 -1.640989 -0.814767
C -1.561684 -1.073005 -0.867066
C -0.555391 -2.203771 -0.599875
C 1.641412 -1.001239 1.534124
C 2.442905 0.269442 -0.531559
C -2.175780 1.339602 -0.486048
C -2.010153 -0.230388 1.500453
H 1.627720 -2.424164 -0.676076
H 0.939223 -1.294299 -1.864552
H -1.423919 -0.713804 -1.906854
H -2.603940 -1.435131 -0.787586
H -0.734782 -3.044236 -1.296083
H -0.673829 -2.610134 0.423075
H 0.851752 -1.640926 1.966670
H 2.561493 -1.606825 1.441012
H 1.845160 -0.167686 2.225639
H 2.109477 0.835493 -1.419991
H 2.936993 0.964199 0.160364
H 3.170468 -0.494516 -0.865280
H -1.690974 1.681507 -1.417669
H -3.212695 1.036538 -0.722744
H -2.201179 2.183478 0.219308
H -3.094463 -0.423423 1.408162
H -1.537638 -1.128452 1.936019
H -1.861188 0.612309 2.196757


