%chk=000015468.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000015468

0 1
 O   0.7563000       2.675700      0.1089000    
 N  -0.3468000      0.6476000      0.3375000    
 N    1.624700      -1.112700      -1.144200    
 N   -3.608400       2.346900     -0.2435000    
 C   -1.581800       1.377800      0.6704000    
 C  -0.4694000     -0.7801000      0.1699000    
 C   -2.399000       1.638300     -0.5884000    
 C   0.4044000      -1.554900     -0.6110000    
 C   0.8006000       1.441800      0.1801000    
 C    2.164900      0.8808000      0.1838000    
 C    2.536500     -0.2365000     -0.5537000    
 C   -1.602600      -1.434400      0.7168000    
 C   -1.875600      -2.785500      0.4926000    
 C   0.1000000      -2.921600     -0.8402000    
 C   -1.025900      -3.531500     -0.2997000    
 C    3.149500       1.639500      0.8493000    
 C    3.906200     -0.5693000     -0.6232000    
 C   -4.413800       1.583400      0.7194000    
 C   -4.410800       2.639100      -1.439000    
 C   -3.083000      -3.416600       1.099000    
 C    4.496300       1.288200      0.7809000    
 C    4.877700      0.1841000      3.4299999E-02
 H   -2.089700      0.9046000       1.507100    
 H   -1.304400       2.355000       1.091500    
 H   -1.797900       2.236700      -1.285200    
 H   -2.626200      0.6958000      -1.103500    
 H   -2.321600     -0.9301000       1.351900    
 H    2.028800      -1.729500      -1.842600    
 H   0.7728000      -3.531800      -1.442100    
 H   -1.213300      -4.582600     -0.4974000    
 H    2.879200       2.523200       1.423800    
 H    4.223700      -1.447600      -1.183100    
 H   -3.988700       1.613200       1.726600    
 H   -4.557300      0.5412000      0.4115000    
 H   -5.407700       2.035400      0.8270000    
 H   -4.749400       1.725200      -1.940600    
 H   -3.829900       3.231900      -2.154300    
 H   -5.289600       3.238500      -1.176600    
 H   -3.065100      -4.507200      0.9999000    
 H   -3.139000      -3.188600       2.168800    
 H   -3.988600      -3.045900      0.6078000    
 H    5.242100       1.882700       1.299600    
 H    5.923800     -9.8800004E-02 -3.0500000E-02


%chk=000015468-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000015468

0 1
O 0.382725 2.443363 1.021076
N -0.584614 0.393240 0.563877
N 1.186996 -1.057931 -1.270351
N -3.627517 2.444965 -0.459804
C -1.905916 1.079095 0.704591
C -0.561056 -1.046459 0.493105
C -2.247419 1.920173 -0.552279
C 0.231753 -1.739689 -0.462306
C 0.537589 1.229744 0.660865
C 1.912551 0.747462 0.290662
C 2.192007 -0.227162 -0.713328
C -1.420698 -1.796477 1.334840
C -1.579555 -3.196972 1.205161
C 0.079589 -3.141378 -0.599201
C -0.829876 -3.859859 0.202642
C 2.992604 1.498110 0.829026
C 3.524752 -0.372393 -1.191524
C -4.652415 1.483453 -0.906738
C -3.803948 3.776995 -1.069269
C -2.535861 -3.955267 2.109981
C 4.315330 1.319496 0.386505
C 4.574921 0.392384 -0.652709
H -2.679582 0.311532 0.851428
H -1.888959 1.747848 1.580667
H -1.542647 2.766750 -0.602146
H -2.090931 1.295181 -1.465974
H -1.988168 -1.269722 2.110798
H 1.500296 -1.597118 -2.081938
H 0.691881 -3.671548 -1.339728
H -0.935719 -4.942109 0.067014
H 2.746926 2.263654 1.571585
H 3.732233 -1.109936 -1.977446
H -4.536531 0.521338 -0.376753
H -4.607552 1.273683 -2.006477
H -5.659277 1.875060 -0.673831
H -3.680788 3.781852 -2.182300
H -3.071246 4.481690 -0.639508
H -4.816740 4.157274 -0.840764
H -2.400651 -5.046155 2.012312
H -2.383591 -3.690262 3.172290
H -3.591387 -3.727499 1.865712
H 5.128680 1.907831 0.822421
H 5.593813 0.257165 -1.032581


