%chk=000003411.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000003411

0 1
 O   -1.828500     -8.8900000E-02  -1.045400    
 O   -2.788900       2.591900      0.5118000    
 O   -1.785800     -0.5507000       1.923800    
 O   -3.486500      -2.309400      -1.501600    
 O    4.716100      3.5700001E-02  4.2800002E-02
 N    1.145100       2.031800     -0.7111000    
 N   0.8520000      -1.322900      0.2086000    
 N    2.452200       1.722200     -0.5531000    
 N    3.241200      -1.701900      0.4474000    
 C   -1.880800       1.514700      0.7346000    
 C   -1.202600       1.130600     -0.5886000    
 C   -2.643500      0.2684000       1.139600    
 C   -2.958600     -0.3733000     -0.2053000    
 C   0.2921000      0.9920000     -0.4681000    
 C   -3.197500      -1.871900     -0.1836000    
 C    1.100400     -5.0000001E-02 -0.1333000    
 C    2.414900      0.4356000     -0.1964000    
 C    3.569900     -0.3931000      9.9600002E-02
 C    1.988800      -2.060700      0.4783000    
 H   -1.413000       1.882600      -1.360100    
 H   -1.169200       1.844100       1.499900    
 H   -3.555800      0.4675000       1.710500    
 H   -3.813800      0.1318000     -0.6728000    
 H   -4.041900      -2.123300      0.4654000    
 H   -2.308400      -2.414500      0.1515000    
 H   -2.264400       3.358400      0.2234000    
 H   0.9100000       2.977200     -0.9863000    
 H   -1.597300     -7.1599998E-02   2.748600    
 H  -7.2999999E-02  -1.733400      0.2750000    
 H   -3.639500      -3.268700      -1.457800    
 H    1.741000      -3.098200      0.7552000    


%chk=000003411-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000003411

0 1
O -1.758102 -0.080456 -1.110378
O -2.769347 2.426739 0.937530
O -1.740021 -1.004612 1.729188
O -4.174995 -1.919406 -1.704860
O 4.889485 -0.087167 -0.266636
N 1.170254 1.869711 -1.346160
N 0.969347 -0.981206 0.811754
N 2.510920 1.552049 -1.260956
N 3.344082 -1.455505 0.872527
C -1.782218 1.345273 0.882148
C -1.166720 1.174150 -0.563904
C -2.590555 0.044148 1.116175
C -2.971626 -0.386640 -0.309109
C 0.320527 1.046322 -0.608899
C -3.341617 -1.851860 -0.497764
C 1.190393 0.114891 -0.014808
C 2.521432 0.455120 -0.428609
C 3.691049 -0.334205 0.027991
C 2.087885 -1.708258 1.200803
H -1.505840 2.034782 -1.180661
H -0.993108 1.483119 1.646550
H -3.471565 0.248763 1.749604
H -3.817140 0.247005 -0.648180
H -3.908044 -2.207858 0.388425
H -2.414210 -2.448580 -0.591306
H -2.319776 3.304779 0.855971
H 0.899123 2.647036 -1.947098
H -1.801514 -0.944005 2.713646
H 0.006823 -1.215532 1.118280
H -4.177581 -2.842240 -2.059924
H 1.877357 -2.574355 1.841160


