%chk=000043817.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000043817

0 1
 O   -3.306200      -1.819700     -0.2736000    
 N   -2.623000      0.4010000      8.6900003E-02
 N   -7.633100      0.5448000      4.3800000E-02
 C    3.042500      5.7399999E-02  1.2800000E-02
 C    5.234300       1.369900      0.2213000    
 C    5.103800     -0.9743000       1.115300    
 C    5.097100     -0.5678000      -1.371900    
 C    3.698600       1.454800      0.2392000    
 C    3.567800     -0.8827000       1.138100    
 C    3.561000     -0.4751000      -1.356100    
 C    5.701000      0.4226000       1.335500    
 C    5.694100      0.8270000      -1.138900    
 C    5.559400      -1.512900     -0.2507000    
 C    1.554200      0.1478000      3.1800002E-02
 C   0.9325000       1.379800      0.2350000    
 C   0.7832000      -1.000100     -0.1530000    
 C  -0.4597000       1.464100      0.2536000    
 C  -0.6091000     -0.9159000     -0.1347000    
 C   -1.230600      0.3163000      6.8499997E-02
 C   -3.552500     -0.6343000     -7.9200000E-02
 C   -4.980000     -0.2220000     -3.6300000E-02
 C   -5.924600      -1.134900      0.3680000    
 C   -5.313500       1.060300     -0.4019000    
 C   -7.240400     -0.7015000      0.3910000    
 C   -6.656700       1.395400     -0.3445000    
 H    5.660900       2.366400      0.3830000    
 H    5.443400      -1.649100       1.909100    
 H    5.431900     -0.9543000      -2.341000    
 H    3.401100       1.877300       1.208900    
 H    3.396400       2.163600     -0.5441000    
 H    3.155800      -1.894100       1.029600    
 H    3.234300     -0.5197000       2.119800    
 H    3.222600      0.1812000      -2.169400    
 H    3.148600      -1.468700      -1.573000    
 H    6.796400      0.3653000       1.344900    
 H    5.394500      0.8123000       2.313900    
 H    5.382600       1.507800      -1.940600    
 H    6.789300      0.7768000      -1.172000    
 H    6.652100      -1.608400     -0.2693000    
 H    5.149700      -2.517200     -0.4138000    
 H    1.459300       2.314200      0.3858000    
 H    1.242100      -1.971700     -0.3131000    
 H  -0.9315000       2.430600      0.4128000    
 H   -1.135200      -1.847900     -0.2852000    
 H   -2.973500       1.334100      0.2841000    
 H   -5.679000      -2.147800      0.6650000    
 H   -4.609200       1.799400     -0.7627000    
 H   -8.039200      -1.367300      0.7010000    
 H   -6.994800       2.386900     -0.6277000    


%chk=000043817-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000043817

0 1
O -3.365136 -1.867942 -0.242334
N -2.691742 0.354564 0.115281
N -7.857941 0.530583 0.020124
C 3.138106 0.108332 0.027661
C 5.360650 1.380197 0.143992
C 5.199344 -0.936219 1.150763
C 5.161533 -0.639598 -1.367591
C 3.813439 1.503426 0.184895
C 3.652515 -0.807940 1.191167
C 3.615873 -0.508102 -1.332092
C 5.839571 0.468599 1.305314
C 5.801268 0.764293 -1.211517
C 5.631840 -1.556336 -0.205868
C 1.601298 0.183836 0.059105
C 0.891206 1.393402 0.275831
C 0.823742 -0.991362 -0.130094
C -0.517264 1.426038 0.295457
C -0.584004 -0.983583 -0.117500
C -1.270775 0.241441 0.094953
C -3.645330 -0.640847 -0.069984
C -5.084086 -0.171373 -0.038268
C -6.085777 -1.153937 0.159889
C -5.505483 1.170832 -0.226210
C -7.440775 -0.762423 0.185935
C -6.886957 1.468259 -0.187938
H 5.804685 2.389373 0.256244
H 5.529666 -1.590773 1.981766
H 5.464833 -1.082027 -2.337260
H 3.509718 1.962739 1.147824
H 3.474006 2.180135 -0.625819
H 3.189574 -1.811225 1.111482
H 3.328214 -0.379540 2.160860
H 3.265971 0.133843 -2.165365
H 3.155031 -1.504127 -1.479187
H 6.944986 0.386910 1.293244
H 5.553575 0.910922 2.280943
H 5.487493 1.420372 -2.048487
H 6.906408 0.687650 -1.251440
H 6.733891 -1.672390 -0.236592
H 5.193361 -2.568574 -0.319100
H 1.434056 2.330025 0.429225
H 1.326258 -1.951378 -0.296096
H -1.033437 2.381215 0.463439
H -1.156214 -1.900411 -0.267854
H -3.044220 1.292920 0.316272
H -5.787602 -2.199406 0.280573
H -4.802046 1.984990 -0.437617
H -8.234436 -1.500733 0.343560
H -7.240184 2.495052 -0.335581


