%chk=000065031.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000065031

0 1
 O   -1.413400      0.5375000      -1.037300    
 O   -1.158700      -2.341700       1.083400    
 O   -3.377700      -1.606300     -0.3192000    
 O   -2.422600       3.042700     -0.2794000    
 O    4.535300      0.9614000      0.4004000    
 N   0.7143000     -0.1725000     -0.2710000    
 N    3.060100     -0.7146000     -0.1563000    
 N    1.514500      -2.356100     -0.7159000    
 C   -1.328700     -0.9699000      0.7881000    
 C   -2.775800     -0.6178000      0.5161000    
 C  -0.6512000     -0.5642000     -0.5113000    
 C   -2.644700      0.6641000     -0.2938000    
 C   -2.551900       1.915400      0.5691000    
 C    1.809400      -1.057700     -0.3708000    
 C    1.032300       1.133800      8.5000001E-02
 C    2.273600       1.562900      0.3206000    
 C    3.385400      0.5830000      0.1922000    
 H  -0.9629000     -0.3846000       1.640600    
 H   -3.386200     -0.5276000       1.418300    
 H  -0.7191000      -1.346400      -1.273600    
 H   -3.448300      0.7768000      -1.030400    
 H   -1.696500       1.895700       1.248800    
 H   -3.463800       2.035000       1.162900    
 H  -0.2112000      -2.489900       1.242700    
 H   -2.918900      -1.620800      -1.175500    
 H   0.2077000       1.826400      0.1631000    
 H   -2.376900       3.828000      0.2921000    
 H    2.497100       2.586100      0.5937000    
 H    2.262000      -3.035500     -0.8137000    
 H   0.5741000      -2.721900     -0.7896000    


%chk=000065031-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000065031

0 1
O -1.540473 0.375880 -1.189919
O -1.288912 -2.760494 0.471901
O -3.556049 -1.631359 -0.408129
O -1.993596 2.955209 0.125745
O 4.468646 1.474223 0.427377
N 0.700731 -0.012871 -0.318791
N 3.011667 -0.367689 0.315103
N 1.562453 -2.191835 0.175519
C -1.320789 -1.309305 0.554242
C -2.772833 -0.749506 0.478219
C -0.608340 -0.627296 -0.675209
C -2.570938 0.645711 -0.131780
C -2.137336 1.711133 0.882466
C 1.791795 -0.832826 0.068077
C 0.951114 1.357354 -0.515349
C 2.194843 1.879578 -0.275859
C 3.312067 1.018550 0.177114
H -0.824058 -1.029802 1.497686
H -3.296072 -0.761077 1.445594
H -0.440852 -1.368665 -1.480458
H -3.456560 1.011047 -0.677865
H -1.187336 1.428401 1.381875
H -2.932310 1.798587 1.654887
H -2.128320 -3.038517 0.004652
H -3.424654 -1.339735 -1.349245
H 0.098803 1.941734 -0.871272
H -1.670188 3.676797 0.721173
H 2.388550 2.943627 -0.429327
H 2.384936 -2.729737 0.444616
H 0.641310 -2.645818 0.176258


