%chk=000107641.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000107641

0 1
 O    1.830500      -1.950200     -0.8433000    
 O   -6.207000     -0.5939000      0.9802000    
 O   -4.213300      -1.471800       1.603000    
 N    1.454400      0.2067000      7.0200004E-02
 C    2.314100       1.290600      0.5519000    
 C    3.684600      0.7455000      0.3475000    
 C   -4.218300      0.4073000      3.7200000E-02
 C   6.5499999E-02  0.2556000      6.2199999E-02
 C    3.620000     -0.5306000     -0.2003000    
 C   -2.727900      0.3545000      4.6200000E-02
 C    2.208900     -0.8879000     -0.3824000    
 C   -4.878000      0.2648000      -1.363300    
 C  -0.6004000       1.390300      0.5338000    
 C  -0.6734000     -0.8293000     -0.4177000    
 C   -1.994500       1.439400      0.5260000    
 C   -2.067400     -0.7801000     -0.4256000    
 C    4.907600       1.328700      0.6220000    
 C    4.748700      -1.272300     -0.4948000    
 C   -4.848800     -0.6501000      0.9554000    
 C   -4.458600       1.372300      -2.321700    
 C    6.066200      0.6004000      0.3338000    
 C    5.987000     -0.6899000     -0.2202000    
 H    2.117900       1.473300       1.613000    
 H    2.152900       2.186800     -5.5399999E-02
 H   -4.538300       1.371000      0.4590000    
 H   -4.637300     -0.7089000      -1.807200    
 H   -5.970500      0.2993000      -1.274900    
 H  -6.5600000E-02   2.255400      0.9150000    
 H  -0.2590000      -1.748200     -0.8026000    
 H   -2.493400       2.331100      0.8964000    
 H   -2.622300      -1.635000     -0.8029000    
 H    4.973400       2.323500       1.049000    
 H    4.684700      -2.266400     -0.9218000    
 H   -4.686900       2.358400      -1.905100    
 H   -3.388000       1.329000      -2.543600    
 H   -4.997900       1.272400      -3.269200    
 H    7.040600       1.035500      0.5399000    
 H    6.900600      -1.237300     -0.4360000    
 H   -6.589900      -1.278700       1.568900    


%chk=000107641-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000107641

0 1
O 1.881453 -2.099236 -0.874367
O -5.304582 -0.222195 2.082251
O -5.142999 -1.891573 0.478915
N 1.442917 0.088855 0.022685
C 2.247597 1.232846 0.524740
C 3.677259 0.752418 0.374864
C -4.369833 0.407045 -0.062367
C 0.020637 0.143741 0.001227
C 3.670588 -0.550172 -0.168714
C -2.838365 0.305972 -0.022253
C 2.267318 -0.993312 -0.400531
C -4.942443 0.307457 -1.508573
C -0.646296 1.318790 0.446021
C -0.763712 -0.956566 -0.451922
C -2.053743 1.390452 0.432922
C -2.167641 -0.865712 -0.457831
C 4.889468 1.393939 0.683837
C 4.863714 -1.254286 -0.421940
C -4.965626 -0.696991 0.805996
C -4.475006 1.467745 -2.409379
C 6.097152 0.694829 0.433691
C 6.085993 -0.615015 -0.113745
H 1.990728 1.456689 1.578778
H 2.049759 2.142483 -0.075801
H -4.668970 1.372827 0.382887
H -4.643535 -0.664262 -1.942488
H -6.048597 0.298782 -1.452265
H -0.080168 2.183470 0.804940
H -0.262208 -1.865063 -0.789991
H -2.545317 2.305639 0.783634
H -2.751697 -1.729905 -0.795001
H 4.911078 2.404902 1.105990
H 4.826700 -2.263771 -0.843896
H -4.798075 2.445563 -2.004069
H -3.374353 1.485773 -2.500512
H -4.899385 1.367518 -3.424609
H 7.055514 1.172370 0.666054
H 7.034690 -1.130921 -0.296792
H -5.649113 -0.979927 2.630215


