%chk=000001616.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000001616

0 1
 O   -1.816500       2.338400     -7.9999998E-04
 O   -1.043300      -2.938800      3.0000001E-04
 N   -2.638200      0.2247000      9.9999997E-05
 N   -2.450000      -1.133200      1.9999999E-04
 N   0.7508000       2.837800      7.9999998E-04
 N    3.658800      -1.008500       0.000000    
 C  -0.2372000      0.5697000       0.000000    
 C  -4.5600001E-02 -0.8118000     -1.9999999E-04
 C   0.8679000       1.428900      9.9999997E-05
 C    1.251600      -1.337700     -9.9999997E-05
 C   -1.602200       1.129500      1.9999999E-04
 C    2.351100     -0.4788000     -1.9999999E-04
 C   -1.206700      -1.721800     -1.9999999E-04
 C    2.159600      0.9016000     -9.9999997E-05
 H    1.413600      -2.413100     -1.9999999E-04
 H    3.021900       1.565700       0.000000    
 H   -3.604400      0.5347000     -1.9999999E-04
 H   -3.295200      -1.694500      6.0000003E-04
 H  -0.1565000       3.281600      3.0000001E-04
 H    1.583100       3.412800      9.9999997E-05
 H    3.799300      -2.010000     -6.9999998E-04
 H    4.456700     -0.3871000     -6.9999998E-04


%chk=000001616-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000001616

0 1
O -1.912476 2.424895 0.000260
O -1.088072 -3.020588 -0.000073
N -2.640273 0.245312 0.000186
N -2.434308 -1.150207 0.000082
N 0.732787 2.856597 0.000154
N 3.673754 -1.035784 -0.000200
C -0.247390 0.615716 0.000049
C -0.027856 -0.801801 -0.000094
C 0.906982 1.488561 0.000064
C 1.258186 -1.354652 -0.000185
C -1.600213 1.174445 0.000149
C 2.395017 -0.491246 -0.000154
C -1.178894 -1.751436 -0.000065
C 2.206865 0.913706 -0.000026
H 1.359601 -2.444786 -0.000255
H 3.080696 1.577875 0.000002
H -3.602788 0.586672 0.000020
H -3.263261 -1.747936 0.000323
H -0.236708 3.208306 -0.000198
H 1.533968 3.481856 -0.000002
H 3.804863 -2.043197 -0.000417
H 4.498120 -0.442209 -0.000321


