%chk=000117038.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000117038

0 1
 O   -1.507300       1.290300     -2.3000001E-03
 O   -3.689900       1.986000      1.1000000E-03
 N    3.086600     -0.1910000     -7.7999998E-03
 C    1.707700     -0.4889000     -4.6999999E-03
 C   -1.026900      -1.095800      1.6000000E-03
 C  -0.5845000      0.2244000     -1.9000000E-03
 C   0.7718000      0.5431000     -5.2000000E-03
 C    1.282300      -1.819400     -1.4000000E-03
 C  -8.2000002E-02  -2.124200      1.7000000E-03
 C    3.591900       1.146800     -1.1300000E-02
 C   -2.456300      -1.356000      4.9999999E-03
 C    5.110800       1.160000      2.0900000E-02
 C   -3.324000     -0.3409000      4.1999999E-03
 C   -2.880100       1.065400      1.9999999E-04
 H    1.057700       1.590100     -8.9999996E-03
 H    2.005500      -2.631300     -1.1000000E-03
 H    3.732200     -0.9730000     -1.2000000E-02
 H  -0.3922000      -3.166100      4.3000001E-03
 H    3.262400       1.679400     -0.9112000    
 H    3.230200       1.697600      0.8651000    
 H   -2.804700      -2.382800      8.1000002E-03
 H    5.488400      0.6591000      0.9187000    
 H    5.525800      0.6423000     -0.8505000    
 H    5.485000       2.188500      1.8999999E-02
 H   -4.392400     -0.5273000      6.6999998E-03


%chk=000117038-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000117038

0 1
O -1.535163 1.277595 -0.003158
O -3.708590 2.062074 -0.006112
N 3.079282 -0.172006 0.002385
C 1.725586 -0.461313 0.001454
C -1.062480 -1.136424 0.001357
C -0.616510 0.222915 -0.000775
C 0.744130 0.569433 -0.000969
C 1.295524 -1.836009 0.003545
C -0.061383 -2.154281 0.003385
C 3.638811 1.187956 -0.001177
C -2.478327 -1.386130 0.001070
C 5.174515 1.138273 0.010148
C -3.395577 -0.351106 -0.001161
C -2.985672 1.045356 -0.003409
H 1.013672 1.627840 -0.003589
H 2.050379 -2.631320 0.005552
H 3.739186 -0.949994 -0.002345
H -0.375531 -3.204811 0.004995
H 3.285151 1.737804 -0.898082
H 3.272483 1.745940 0.885296
H -2.832226 -2.424231 0.002660
H 5.550748 0.624433 0.913633
H 5.563764 0.613706 -0.881728
H 5.589422 2.160344 0.006679
H -4.473193 -0.529743 -0.001452


