%chk=000101195.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000101195

0 1
 O    1.241800     -0.4638000       1.928700    
 O    5.130200     -0.1204000     -0.6389000    
 O   -1.185600       2.504100      0.6116000    
 O  -0.2482000      -1.809700     -0.7952000    
 N  -0.2893000      0.4454000     -0.1050000    
 N    3.177600     -0.3865000      0.6252000    
 C    1.116100      0.7614000     -0.1330000    
 C    1.693700      0.5455000      -1.517500    
 C    3.163000      0.9028000      -1.487200    
 C    1.818000     -0.1084000      0.8975000    
 C    3.922000      6.9600001E-02 -0.4811000    
 C   -1.278300       1.343300      0.2584000    
 C  -0.8122000     -0.7921000     -0.4383000    
 C   -2.543400      0.6196000      0.1377000    
 C   -2.261600     -0.6716000     -0.2835000    
 C    3.876700      -1.196600       1.617600    
 C   -3.834300       1.044800      0.3752000    
 C   -3.256000      -1.605700     -0.4894000    
 C   -4.858400      0.1154000      0.1725000    
 C   -4.572000      -1.197100     -0.2554000    
 H    1.254900       1.804800      0.1765000    
 H    1.172300       1.170400      -2.252200    
 H    1.588600     -0.4941000      -1.848500    
 H    3.306600       1.958700      -1.231800    
 H    3.600700      0.7320000      -2.477100    
 H    4.833800      -1.569000       1.243900    
 H    3.250500      -2.046300       1.907300    
 H    4.051500     -0.5769000       2.502900    
 H   -4.054700       2.053300      0.7047000    
 H   -3.036300      -2.614600     -0.8179000    
 H   -5.891000      0.4061000      0.3471000    
 H   -5.387900      -1.899500     -0.4047000    


%chk=000101195-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000101195

0 1
O 1.204556 -0.591609 1.819014
O 5.236089 -0.127518 -0.475018
O -1.055832 2.545713 0.518635
O -0.219206 -1.850742 -0.942638
N -0.308155 0.430046 -0.266084
N 3.206143 -0.376432 0.654884
C 1.122513 0.727158 -0.256257
C 1.791451 0.585492 -1.637735
C 3.285485 0.925361 -1.499376
C 1.820154 -0.140591 0.820057
C 4.000089 0.105853 -0.429501
C -1.296590 1.361752 0.179068
C -0.870088 -0.849170 -0.556138
C -2.594976 0.621209 0.127461
C -2.339942 -0.701362 -0.311838
C 3.866817 -1.185204 1.711857
C -3.892755 1.051577 0.441090
C -3.374533 -1.637732 -0.452827
C -4.946647 0.111128 0.302596
C -4.691479 -1.212708 -0.137524
H 1.196939 1.783549 0.080820
H 1.307616 1.272930 -2.353249
H 1.657352 -0.444554 -2.011002
H 3.416727 1.996279 -1.241287
H 3.832699 0.760592 -2.441973
H 4.938175 -1.236246 1.472162
H 3.427723 -2.195605 1.738006
H 3.709598 -0.713304 2.694860
H -4.077292 2.074597 0.783128
H -3.165459 -2.657774 -0.789644
H -5.973272 0.408848 0.540974
H -5.525099 -1.916633 -0.232420


