%chk=000076007.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000076007

0 1
 O   0.4671000     -0.2385000     -0.3039000    
 O   -3.486700     -0.9831000       1.983000    
 O   -4.943300       1.269800     -0.7977000    
 O   -3.547800       1.888900      0.8819000    
 O  -0.9302000      -1.469000      -1.648600    
 N   -1.752800     -9.4999997E-03 -4.3200001E-02
 C   -3.161500     -0.2211000     -0.2696000    
 C   -3.713900      -1.324300      0.6210000    
 C    2.855000     -0.2694000     -0.3480000    
 C    1.600000     -0.8260000     -0.9536000    
 C   -3.865400       1.090400      9.9999998E-03
 C  -0.7566000     -0.6508000     -0.7513000    
 C    3.427000      0.8792000     -0.8835000    
 C    3.434400     -0.9070000      0.7434000    
 C    4.593500       1.396800     -0.3206000    
 C    4.600900     -0.3892000       1.306400    
 C    5.180400      0.7627000      0.7744000    
 H   -3.302900     -0.4826000      -1.324600    
 H   -3.214400      -2.277300      0.4185000    
 H   -4.791500      -1.447200      0.4716000    
 H   -1.468300      0.6334000      0.6905000    
 H    1.566700     -0.6045000      -2.027600    
 H    1.571700      -1.916200     -0.8325000    
 H    2.977000       1.382500      -1.734700    
 H    2.990200      -1.803400       1.167200    
 H    5.044500       2.294000     -0.7343000    
 H    5.057700     -0.8824000       2.159400    
 H    6.088400       1.166000       1.212900    
 H   -3.849800      -1.706200       2.522300    
 H   -5.411600       2.109000     -0.6011000    


%chk=000076007-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000076007

0 1
O 0.489942 -0.159976 -0.250860
O -3.732579 -1.003827 1.828235
O -5.297956 1.017301 -0.289480
O -3.494007 2.171676 0.614891
O -0.987026 -1.514571 -1.504577
N -1.754433 0.157184 -0.053478
C -3.164867 -0.093885 -0.329461
C -3.727329 -1.336600 0.399248
C 2.909034 -0.325053 -0.318463
C 1.633348 -0.900993 -0.881412
C -3.956518 1.153248 0.062780
C -0.780342 -0.585464 -0.673412
C 3.519453 0.801077 -0.926141
C 3.513990 -0.899703 0.827311
C 4.709593 1.346679 -0.396310
C 4.704886 -0.357689 1.360068
C 5.305125 0.767626 0.748792
H -3.301160 -0.273151 -1.413424
H -3.068683 -2.196784 0.170341
H -4.751984 -1.535730 0.027506
H -1.506005 0.887341 0.617871
H 1.559475 -0.773010 -1.976085
H 1.516507 -1.974246 -0.648339
H 3.057428 1.252308 -1.812534
H 3.047986 -1.770436 1.304363
H 5.172404 2.217269 -0.874136
H 5.163881 -0.810473 2.245932
H 6.229937 1.188346 1.159449
H -3.949572 -1.805644 2.363449
H -5.802729 1.822178 0.005578


