%chk=000027823.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000027823

0 1
 O    6.373200      0.7468000      2.4100000E-02
 N    4.365000     -0.1542000     -0.1514000    
 N   -1.186200      4.1499998E-02  0.5498000    
 N   -1.800400     -7.0500001E-02 -0.5365000    
 N    5.163800      0.8980000      0.2249000    
 C    2.966500     -0.1051000      2.5200000E-02
 C    2.299800       1.119100     -2.5200000E-02
 C    2.250100      -1.280600      0.2505000    
 C   0.2129000     -8.1000002E-03  0.3731000    
 C   0.9168000       1.167900      0.1495000    
 C   0.8670000      -1.231800      0.4252000    
 C    4.905500      -1.394600     -0.7575000    
 C   -3.179900     -1.2500000E-02 -0.3141000    
 C   -3.839900       1.215900     -0.3426000    
 C   -3.895600      -1.183100     -6.3400000E-02
 C   -5.215700       1.273600     -0.1206000    
 C   -5.271400      -1.125300      0.1587000    
 C   -5.931600      0.1030000      0.1301000    
 H    2.826500       2.051500     -0.2112000    
 H    2.732800      -2.251200      0.3173000    
 H   0.4037000       2.124600      0.1068000    
 H   0.3157000      -2.150600      0.6052000    
 H    5.882000      -1.223900      -1.224900    
 H    4.252100      -1.770200      -1.553900    
 H    5.035000      -2.167300      8.0000004E-03
 H   -3.291100       2.133700     -0.5377000    
 H   -3.390400      -2.145300     -3.9799999E-02
 H   -5.729900       2.230100     -0.1429000    
 H   -5.828800      -2.036900      0.3538000    
 H   -7.002900      0.1480000      0.3029000    


%chk=000027823-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000027823

0 1
O 6.522622 0.762545 -0.250736
N 4.481823 -0.227433 -0.217716
N -1.152452 0.552717 -0.015676
N -1.922897 -0.507921 -0.011010
N 5.260106 0.956084 -0.202309
C 3.068100 -0.048696 -0.165389
C 2.498303 1.256761 -0.120466
C 2.212919 -1.188958 -0.158956
C 0.246324 0.267728 -0.065802
C 1.104574 1.401657 -0.071199
C 0.819726 -1.033530 -0.110042
C 5.116292 -1.555245 -0.285238
C -3.326436 -0.224991 0.038496
C -3.895802 1.080782 0.076582
C -4.170139 -1.367615 0.047612
C -5.294293 1.225836 0.123313
C -5.571222 -1.212806 0.095088
C -6.136786 0.083632 0.132965
H 3.150837 2.131130 -0.125340
H 2.634862 -2.197467 -0.191372
H 0.646227 2.395227 -0.036636
H 0.153707 -1.901489 -0.105259
H 6.204624 -1.385313 -0.331707
H 4.789346 -2.098113 -1.188663
H 4.876325 -2.150451 0.612829
H -3.227162 1.946873 0.068603
H -3.702491 -2.357325 0.017087
H -5.737728 2.227551 0.152267
H -6.219733 -2.095446 0.102523
H -7.224975 0.206778 0.169550


