%chk=000032989.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000032989

1 1
 O    2.206200      0.6097000      0.5261000    
 N   -3.317000      0.1900000     -0.1449000    
 C   -2.235600     -0.2992000      0.8079000    
 C  -0.8864000     -0.2313000      0.1077000    
 C   -3.317300     -0.6734000      -1.398200    
 C   -4.674300      9.4899997E-02  0.5369000    
 C   -3.040800       1.637300     -0.5260000    
 C   0.2408000     -0.6710000       1.046000    
 C    1.588500     -0.5726000      0.3767000    
 C    2.301100      -1.456700     -0.3526000    
 C    3.382200      0.4831000     -0.1429000    
 C    3.488200     -0.7695000     -0.7013000    
 C    4.264300       1.658600     -0.1354000    
 H   -2.261600      0.3387000       1.699100    
 H   -2.484100      -1.326600       1.098800    
 H  -0.8503000     -0.8852000     -0.7696000    
 H  -0.6485000      0.7821000     -0.2291000    
 H   -3.326900      -1.726300      -1.101500    
 H   -4.223300     -0.4400000      -1.967300    
 H   -2.450100     -0.4398000      -2.020800    
 H   -4.653700      0.7198000       1.434700    
 H   -5.441500      0.4505000     -0.1573000    
 H   -4.855400     -0.9512000      0.8012000    
 H   -2.851100       2.212400      0.3850000    
 H   -2.198100       1.695000      -1.218800    
 H   -3.930100       2.027300      -1.032200    
 H   0.2418000     -5.0500002E-02   1.950700    
 H   7.6800004E-02  -1.706400       1.368700    
 H    2.025200      -2.468000     -0.6137000    
 H    4.316100      -1.143200      -1.286800    
 H    3.762800       2.518500     -0.5901000    
 H    4.542200       1.924200      0.8893000    
 H    5.183800       1.466400     -0.6971000    


%chk=000032989-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000032989

1 1
O 2.060974 0.551337 0.200613
N -3.360151 0.276316 -0.174373
C -2.215315 -0.391147 0.643517
C -0.811419 -0.285918 0.034206
C -3.427638 -0.309167 -1.583074
C -4.680716 -0.001644 0.545509
C -3.151068 1.787367 -0.258908
C 0.234022 -0.899962 1.017177
C 1.632483 -0.767446 0.498151
C 2.666572 -1.650474 0.247418
C 3.409277 0.460772 -0.242923
C 3.795315 -0.868917 -0.220693
C 4.083298 1.741682 -0.608539
H -2.243769 0.088781 1.638858
H -2.512224 -1.449292 0.761395
H -0.744009 -0.827099 -0.926504
H -0.517840 0.763929 -0.143057
H -3.512642 -1.404395 -1.513528
H -4.309471 0.103038 -2.097274
H -2.516947 -0.040150 -2.135526
H -4.623202 0.397354 1.569656
H -5.501784 0.488380 0.000059
H -4.851200 -1.088450 0.578470
H -3.083558 2.198277 0.760000
H -2.223924 2.000632 -0.808249
H -4.006314 2.235400 -0.787789
H 0.141581 -0.394817 2.001250
H 0.025910 -1.972822 1.182207
H 2.639473 -2.729897 0.386114
H 4.774741 -1.249537 -0.502353
H 3.562782 2.258566 -1.435898
H 4.123674 2.438806 0.248427
H 5.116986 1.538097 -0.931139


