%chk=000149479.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000149479

0 1
 O   -4.059400      -4.165100     -0.9342000    
 N   -3.737200       1.039400      0.7529000    
 N    4.182100      -1.715100      0.5413000    
 N    2.176100      0.5607000      -1.430200    
 N    2.259500       2.791300     -0.6875000    
 C   -1.863000      0.2505000     -0.1587000    
 C   -2.443400       1.373000      0.4271000    
 C   -1.753300       2.578100      0.6082000    
 C   0.1951000       1.531700     -0.4180000    
 C  -0.4172000       2.652000      0.1779000    
 C   -2.853200     -0.7827000     -0.1781000    
 C  -0.5219000      0.3314000     -0.5881000    
 C   -4.011300     -0.2600000      0.3974000    
 C    4.057000     -0.9714000      -1.819000    
 C    3.648100      -2.020100     -0.7806000    
 C    3.596000      0.4487000      -1.496800    
 C    1.523600       1.665400     -0.8252000    
 C   -2.437400       3.748000       1.244400    
 C   0.3274000       3.827000      0.3298000    
 C   -2.869900      -2.117800     -0.6337000    
 C    5.645100      -1.671100      0.5088000    
 C    3.725800      -2.701600       1.522100    
 C   -5.187800      -1.004100      0.5413000    
 C    1.641200       3.843400     -0.1128000    
 C   -4.039000      -2.874800     -0.4967000    
 C   -5.179700      -2.324000      8.2500003E-02
 C    6.186500      -1.288000       1.872700    
 C    2.210100      -2.744600       1.553200    
 H  -7.6399997E-02 -0.5530000      -1.033200    
 H    5.134600     -0.9823000      -2.012200    
 H    3.602600      -1.268400      -2.774800    
 H    3.983200      -3.008300      -1.123300    
 H    2.554000      -2.038700     -0.7862000    
 H   -4.404700       1.656400       1.193600    
 H    4.055900      0.7734000     -0.5558000    
 H    3.972500       1.120600      -2.277700    
 H    1.626500      1.5300000E-02  -2.085100    
 H   -1.915500       4.043200       2.161200    
 H   -2.464000       4.597200      0.5529000    
 H   -3.472900       3.538400       1.525400    
 H    6.080700      -2.624700      0.1855000    
 H    6.005200     -0.8945000     -0.1717000    
 H    4.122800      -3.703600       1.317000    
 H    4.035600      -2.419300       2.533200    
 H  -7.6399997E-02   4.728200      0.7790000    
 H   -1.980700      -2.549400      -1.085500    
 H   -6.076600     -0.5757000      0.9925000    
 H    2.249000       4.736600     -1.1400000E-02
 H   -6.081200      -2.923900      0.1830000    
 H    5.668400     -0.4171000       2.289400    
 H    6.137600      -2.111400       2.591900    
 H    7.245900      -1.020900       1.783200    
 H    1.769300      -1.742000       1.588200    
 H    1.785800      -3.294900      0.7076000    
 H    1.879900      -3.272200       2.455700    
 H   -3.188500      -4.385600      -1.307100    


%chk=000149479-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000149479

0 1
O -5.051051 -3.776536 -2.181120
N -4.240482 1.057085 0.532909
N 4.894706 -1.682502 0.586836
N 1.927218 0.103956 -1.178149
N 2.186577 2.070016 0.058270
C -2.321786 0.126985 -0.348081
C -2.852987 1.245326 0.406675
C -2.047671 2.283144 0.897672
C -0.090100 1.102628 -0.156336
C -0.638768 2.208791 0.616736
C -3.446158 -0.746606 -0.668943
C -0.949552 0.065394 -0.618110
C -4.618919 -0.139347 -0.108568
C 3.827552 -1.418273 -1.678497
C 3.856720 -2.197513 -0.341659
C 3.362471 0.041816 -1.505000
C 1.353959 1.111777 -0.419118
C -2.624478 3.435486 1.698476
C 0.279270 3.208083 1.096508
C -3.557102 -1.969211 -1.372149
C 6.245978 -2.226367 0.287188
C 4.523066 -1.814366 2.021914
C -5.892021 -0.730980 -0.238865
C 1.636916 3.083754 0.811601
C -4.834626 -2.558169 -1.499737
C -5.990889 -1.949309 -0.941029
C 7.387798 -1.304495 0.758214
C 3.428729 -0.820751 2.457092
H -0.557754 -0.795545 -1.171965
H 4.838735 -1.408468 -2.129097
H 3.171421 -1.952293 -2.400462
H 3.994336 -3.288767 -0.548530
H 2.869514 -2.087818 0.142353
H -4.876982 1.683348 1.018001
H 3.916651 0.515381 -0.679221
H 3.574871 0.627120 -2.424765
H 1.312055 -0.528003 -1.689007
H -2.192551 3.476631 2.716359
H -2.412215 4.408187 1.216251
H -3.719872 3.361939 1.812555
H 6.379470 -3.249338 0.725722
H 6.325536 -2.348057 -0.809477
H 4.206046 -2.861627 2.266301
H 5.431497 -1.617217 2.620161
H -0.074154 4.057553 1.685729
H -2.671800 -2.450086 -1.807910
H -6.788100 -0.268587 0.188147
H 2.356207 3.824752 1.179426
H -6.954323 -2.450635 -1.070870
H 7.289534 -0.310145 0.288886
H 7.379367 -1.163274 1.854080
H 8.370041 -1.733448 0.484010
H 3.742766 0.214141 2.237240
H 2.472404 -0.994130 1.931357
H 3.235372 -0.915083 3.542241
H -4.199942 -4.132747 -2.536939


