%chk=000017088.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000017088

0 1
 O   -1.410400       2.068700       0.000000    
 N   -2.014300     -0.1830000       0.000000    
 N  -0.3557000      -1.886700      1.9999999E-04
 C   0.3185000      0.4766000      1.9999999E-04
 C   0.6334000     -0.8889000      9.9999997E-05
 C   -1.106700      0.8796000      3.9999999E-04
 C    1.327700       1.445200      9.9999997E-05
 C   -1.588400      -1.498700      9.9999997E-05
 C    1.979800      -1.270100     -1.9999999E-04
 C   -3.438000      0.1156000     -6.0000003E-04
 C    2.664100       1.048300     -1.9999999E-04
 C    2.990200     -0.3067000     -3.0000001E-04
 H    1.093700       2.506100      1.9999999E-04
 H   -2.400000      -2.242300       0.000000    
 H    2.250800      -2.323200     -3.0000001E-04
 H   -4.041500     -0.7957000     -6.0000003E-04
 H   -3.671800      0.7123000     -0.8877000    
 H   -3.672500      0.7129000      0.8861000    
 H    3.452000       1.795700     -3.0000001E-04
 H    4.032000     -0.6141000     -5.0000002E-04


%chk=000017088-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000017088

0 1
O -1.520184 2.093220 0.000029
N -2.024206 -0.192290 -0.000394
N -0.335597 -1.921426 -0.000391
C 0.317931 0.480653 -0.000369
C 0.654188 -0.914468 -0.000324
C -1.096699 0.897472 -0.000755
C 1.344758 1.460254 -0.000136
C -1.592700 -1.522530 -0.000342
C 2.022517 -1.300220 -0.000119
C -3.463405 0.146801 -0.000183
C 2.692562 1.063926 0.000063
C 3.028624 -0.319724 0.000069
H 1.053131 2.515759 -0.000191
H -2.389230 -2.274822 -0.000221
H 2.255644 -2.369155 -0.000083
H -4.054205 -0.783228 0.000366
H -3.709398 0.747583 -0.891257
H -3.708941 0.748352 0.890492
H 3.486499 1.818170 0.000208
H 4.081610 -0.622725 0.000237


