%chk=000084349.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000084349

0 1
 O    2.361200       1.032000     -3.4800000E-02
 N   -2.446700      0.8884000      0.2047000    
 C   -1.203800      0.2263000      0.1257000    
 C  -2.1600001E-02  0.9653000      8.3300002E-02
 C    1.207700      0.3108000      6.3999998E-03
 C   -1.156800      -1.167400      9.1100000E-02
 C    1.254800      -1.082800     -2.8500000E-02
 C   7.2600000E-02  -1.821900      1.4000000E-02
 C   -3.650200      0.3498000     -0.3489000    
 C    3.582900      0.2993000     -0.1130000    
 H  -5.0700001E-02   2.052200      0.1097000    
 H   -2.058800      -1.771100      0.1310000    
 H    2.174500      -1.654900     -8.7600000E-02
 H   0.1086000      -2.907200     -1.1100000E-02
 H   -2.409600       1.891600      0.3549000    
 H   -3.515600      5.9200000E-02  -1.396100    
 H   -4.441700       1.105500     -0.3149000    
 H   -4.004000     -0.5139000      0.2228000    
 H    3.646000     -0.2799000      -1.040500    
 H    3.737100     -0.3221000      0.7757000    
 H    4.397500       1.030600     -0.1370000    


%chk=000084349-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000084349

0 1
O 2.389656 1.046130 0.024812
N -2.417528 0.963274 -0.081514
C -1.219643 0.245090 -0.079517
C 0.018789 0.943252 -0.029823
C 1.238098 0.235236 -0.026714
C -1.205124 -1.183811 -0.126676
C 1.263038 -1.183372 -0.073170
C 0.026294 -1.866399 -0.122539
C -3.736745 0.341967 -0.132615
C 3.686780 0.370988 0.031103
H 0.050885 2.038157 0.006224
H -2.141311 -1.747872 -0.166204
H 2.201679 -1.743431 -0.071351
H 0.026444 -2.962342 -0.158891
H -2.360729 1.978709 -0.048374
H -3.877381 -0.261307 -1.053251
H -4.509121 1.129042 -0.123680
H -3.918429 -0.321310 0.738190
H 3.837804 -0.225576 -0.890093
H 3.797592 -0.285752 0.916358
H 4.432352 1.179126 0.074626


