%chk=000176885.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000176885

0 1
 O  -0.7656000     -0.8926000       1.280900    
 O   -3.054100       1.013600       1.261000    
 O   -1.085200       2.407600     -1.6100001E-02
 O   -1.412200      -3.294800      3.1399999E-02
 O    1.619700       2.394900      0.1614000    
 N    1.155000      0.1546000      0.4618000    
 N    3.285900      0.9414000     -0.3512000    
 N    4.988600     -0.5531000     -0.8763000    
 C   -2.427800      0.3617000      0.1541000    
 C   -1.074900      0.9957000     -0.1338000    
 C   -2.023900      -1.052400      0.5840000    
 C  -0.1845000      0.3728000      0.9311000    
 C   -1.784200      -2.055700     -0.5425000    
 C   -3.340600      0.4099000     -0.9900000    
 C    1.623700      -1.146800      0.3687000    
 C    2.005800       1.226700      9.2299998E-02
 C    2.850700      -1.441800     -5.6400001E-02
 C    3.712900     -0.2913000     -0.4329000    
 C   -4.089200      0.4495000      -1.927600    
 H  -0.7323000      0.7376000      -1.144800    
 H   -2.728000      -1.474700       1.310900    
 H  -0.1318000      0.9966000       1.831700    
 H  -0.9757000      -1.737600      -1.207600    
 H   -2.691300      -2.220200      -1.130700    
 H   -3.123300       1.960500       1.048700    
 H  -0.2115000       2.735700     -0.2840000    
 H   0.9886000      -1.974500      0.6538000    
 H   -1.261300      -3.917100     -0.7004000    
 H    3.224800      -2.454200     -0.1293000    
 H   -4.753100      0.4842000      -2.759500    
 H    5.349100      -1.498700     -0.9502000    
 H    5.611800      0.2014000      -1.143500    


%chk=000176885-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000176885

0 1
O -0.823264 -0.848115 1.368330
O -3.087099 1.062246 1.236576
O -1.197114 2.455841 0.017382
O -1.263682 -3.265677 0.052030
O 1.477646 2.336272 0.071442
N 1.195102 0.039681 0.400807
N 3.304321 0.928372 -0.374197
N 5.073085 -0.497638 -0.838020
C -2.470157 0.368027 0.104651
C -1.076184 1.028871 -0.163657
C -2.076141 -1.056308 0.595578
C -0.170617 0.366599 0.922792
C -1.864077 -2.063636 -0.544179
C -3.354059 0.383311 -1.075600
C 1.666109 -1.252573 0.332223
C 2.011655 1.173838 0.020982
C 2.959349 -1.495478 -0.097357
C 3.768411 -0.346120 -0.433561
C -4.118529 0.420487 -2.040422
H -0.710107 0.773692 -1.177780
H -2.815603 -1.437932 1.316562
H -0.045802 1.053789 1.779801
H -1.197510 -1.644219 -1.327941
H -2.849303 -2.282414 -1.001813
H -2.809351 2.019509 1.140449
H -0.240710 2.784641 0.058087
H 0.961853 -2.034628 0.635840
H -1.353127 -4.020617 -0.581455
H 3.341202 -2.516224 -0.155659
H -4.786138 0.471866 -2.880960
H 5.513207 -1.410955 -0.906677
H 5.602737 0.344394 -1.059253


