%chk=000076054.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000076054

0 1
 O   -1.117200      0.3988000     -2.7000001E-03
 O    1.103000      0.4270000      3.4000000E-03
 N   4.4100001E-02  -1.662800       0.000000    
 C   -2.404000     -0.2355000     -6.8999999E-03
 C    2.382600     -0.2200000      6.2000002E-03
 C   -3.479000      0.8303000      5.2999998E-03
 C    3.468400      0.8348000     -5.7999999E-03
 C   2.0999999E-03 -0.3727000      3.9999999E-04
 H   -2.498800     -0.8522000     -0.9070000    
 H   -2.497000     -0.8703000      0.8809000    
 H    2.486700     -0.8302000      0.9103000    
 H    2.484400     -0.8448000     -0.8882000    
 H   -4.475800      0.3803000      2.0999999E-03
 H   -3.380800       1.466500      0.8911000    
 H   -3.383200       1.484100     -0.8678000    
 H    4.460700      0.3753000     -4.0000002E-03
 H    3.375800       1.473200     -0.8907000    
 H    3.380000       1.488800      0.8680000    
 H   0.9938000      -2.034000      3.7000000E-03


%chk=000076054-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000076054

0 1
O -1.101088 0.440584 -0.001117
O 1.126098 0.462959 0.002028
N -0.083561 -1.680127 0.001370
C -2.420404 -0.251856 -0.003745
C 2.443261 -0.214996 0.002622
C -3.480316 0.844805 0.003509
C 3.499709 0.886195 -0.004316
C 0.004271 -0.381728 0.001671
H -2.475679 -0.895881 -0.900295
H -2.473979 -0.906578 0.885048
H 2.528675 -0.851535 0.907324
H 2.525673 -0.859825 -0.896518
H -4.487583 0.389268 0.001214
H -3.385651 1.477829 0.902248
H -3.386718 1.489040 -0.887363
H 4.511267 0.441087 -0.003625
H 3.395057 1.518845 -0.901617
H 3.397816 1.527614 0.887077
H 0.808953 -2.199097 0.002785


