%chk=000025947.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000025947

0 1
 O    3.699300      -1.449500     -0.3458000    
 N   -2.236500       3.636300     -0.2566000    
 C   0.5137000       1.105600      0.3978000    
 C   0.2740000     -0.2368000      9.7999997E-02
 C  -0.6079000       2.055700      0.6714000    
 C   -1.073000     -0.7617000      4.0100001E-02
 C    1.821500       1.588200      0.4476000    
 C   -1.133100       2.762900     -0.5841000    
 C    1.346800      -1.094700     -0.1517000    
 C    2.654500     -0.6120000     -0.1020000    
 C    2.891800      0.7294000      0.1978000    
 C   -1.667000      -1.287500       1.187400    
 C   -1.778300     -0.7403000      -1.163100    
 C   -2.966300      -1.791600       1.131700    
 C   -3.077700      -1.244500      -1.218800    
 C   -3.671700      -1.770100     -7.1500003E-02
 C    5.009900     -0.8894000     -0.2784000    
 H  -0.2611000       2.814900       1.387600    
 H   -1.428500       1.554400       1.198200    
 H    2.021400       2.631700      0.6773000    
 H  -0.3301000       3.354300      -1.038900    
 H   -1.457400       2.040500      -1.338000    
 H    1.175100      -2.143200     -0.3867000    
 H    3.881300       1.170300      0.2524000    
 H   -1.131500      -1.311000       2.133600    
 H   -1.328800     -0.3403000      -2.068800    
 H   -3.429000      -2.200600       2.025000    
 H   -3.626500      -1.228900      -2.155900    
 H   -3.004700       3.093900      0.1363000    
 H   -2.597100       4.067300      -1.106700    
 H   -4.683400      -2.162800     -0.1150000    
 H    5.241500     -0.5275000      0.7291000    
 H    5.157300     -0.1172000      -1.041100    
 H    5.717500      -1.695400     -0.4988000    


%chk=000025947-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000025947

0 1
O 3.674795 -1.423014 -0.601325
N -2.249234 3.770897 -0.088053
C 0.505027 1.172258 0.565890
C 0.263403 -0.163235 0.102097
C -0.611297 2.163168 0.866610
C -1.112441 -0.753970 0.006501
C 1.847152 1.614499 0.641282
C -1.182913 2.805745 -0.426287
C 1.355368 -0.976913 -0.280644
C 2.686929 -0.506942 -0.198499
C 2.943009 0.801588 0.274335
C -1.952273 -0.861404 1.148300
C -1.583667 -1.276863 -1.228191
C -3.227479 -1.461507 1.055125
C -2.859824 -1.875217 -1.323984
C -3.689386 -1.967197 -0.182564
C 5.068725 -0.986060 -0.516385
H -0.238938 2.980849 1.509589
H -1.447600 1.683220 1.406790
H 2.041223 2.635698 0.992161
H -0.371153 3.353602 -0.940914
H -1.510052 1.988919 -1.112618
H 1.187048 -2.002988 -0.622572
H 3.961909 1.190827 0.359182
H -1.588139 -0.504575 2.118635
H -0.945512 -1.201093 -2.116445
H -3.854938 -1.544447 1.949961
H -3.205700 -2.267584 -2.287130
H -3.075061 3.334945 0.336157
H -2.506517 4.401117 -0.853869
H -4.678823 -2.432609 -0.254561
H 5.353029 -0.741428 0.526190
H 5.257914 -0.107673 -1.164731
H 5.661415 -1.842211 -0.870632


