%chk=000062450.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000062450

0 1
 O   -3.421900       1.796200      -2.149400    
 O    3.419900      -1.798100      -2.149300    
 N   -2.312200       1.498300     -9.3599997E-02
 N    2.310600      -1.499200     -9.3300000E-02
 C  -8.9999998E-04 -6.9999998E-04 -0.9382000    
 C   -1.096500     -0.6058000     -0.1226000    
 C    1.110000      0.6132000     -0.1119000    
 C   -2.201300      0.1502000      0.2689000    
 C    2.199800     -0.1510000      0.2685000    
 C   -1.003100      -1.947500      0.2470000    
 C    1.001600       1.946700      0.2458000    
 C   -3.212700     -0.4356000       1.030300    
 C    3.211300      0.4352000       1.029400    
 C   -2.014500      -2.533400       1.008300    
 C    2.013100       2.533000       1.006600    
 C   -3.119200      -1.777300       1.400000    
 C    3.118000       1.777100       1.398300    
 C   -2.867600       1.646800      -1.122300    
 C    2.865700      -1.648200      -1.122200    
 H   0.3932000     -0.7533000      -1.632600    
 H  -0.3871000      0.7566000      -1.632000    
 H  -0.1603000      -2.559500     -5.9000000E-02
 H   0.1578000       2.555200     -6.1999999E-02
 H   -4.077600      0.1435000       1.343700    
 H    4.076300     -0.1437000       1.342900    
 H   -1.943600      -3.578900       1.293300    
 H    1.942200       3.578700       1.291100    
 H   -3.906800      -2.233500       1.992500    
 H    3.905700       2.233700       1.990400    


%chk=000062450-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000062450

0 1
O -2.948893 3.484542 0.773824
O 2.942710 -3.494288 0.763429
N -2.100143 1.280013 0.188541
N 2.103004 -1.279718 0.203509
C 0.015851 0.014040 -1.322919
C -1.012089 -0.778041 -0.515379
C 1.026338 0.791279 -0.479892
C -2.037706 -0.116941 0.222025
C 2.037723 0.116236 0.264568
C -0.990282 -2.192346 -0.491291
C 1.002285 2.204766 -0.427665
C -2.993496 -0.856667 0.968379
C 2.976901 0.841463 1.045440
C -1.937612 -2.937354 0.244709
C 1.933325 2.935480 0.342664
C -2.940039 -2.264490 0.980775
C 2.921143 2.248667 1.085552
C -2.571306 2.351321 0.523279
C 2.568517 -2.356824 0.527514
H 0.555768 -0.694183 -1.978300
H -0.510367 0.733370 -1.977384
H -0.213649 -2.715107 -1.060852
H 0.236909 2.738366 -1.002328
H -3.769722 -0.321163 1.525912
H 3.742248 0.295454 1.607804
H -1.892687 -4.031270 0.245033
H 1.887029 4.029125 0.364195
H -3.678788 -2.830604 1.557986
H 3.646928 2.803575 1.689471


