%chk=000080664.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000080664

0 1
 O  -0.1665000      -2.605800     -1.5000000E-03
 N   -3.050600      -1.756100      1.2000001E-03
 C  -0.4034000      0.8883000     -5.0000002E-04
 C    1.028600      0.6803000     -3.9999999E-04
 C   -1.050400     -0.3597000     -1.9999999E-04
 C    1.294000     -0.7000000     -1.9999999E-04
 C  -5.2999998E-03  -1.405000     -9.9999997E-05
 C   -2.423200     -0.5014000      3.9999999E-04
 C   -1.156800       2.048800     -6.9999998E-04
 C    2.080900       1.578600      9.9999997E-05
 C    2.570000      -1.226200      3.0000001E-04
 C   -3.178300      0.6714000      5.0000002E-04
 C   -2.552600       1.932900     -1.9999999E-04
 C    3.386200       1.070700      5.0000002E-04
 C    3.627400     -0.3167000      6.0000003E-04
 H  -0.6923000       3.029100     -1.1000000E-03
 H    1.914300       2.650600      1.9999999E-04
 H    2.750900      -2.294400      6.0000003E-04
 H   -4.265200      0.6267000      1.0000000E-03
 H   -3.164600       2.831400     -1.9999999E-04
 H    4.228400       1.758000      8.9999998E-04
 H    4.651500     -0.6807000      1.0000000E-03
 H   -4.060000      -1.818300      8.9999998E-04
 H   -2.497500      -2.602600      6.0000003E-04


%chk=000080664-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000080664

0 1
O -0.255596 -2.683270 -0.000308
N -3.023528 -1.767403 0.000507
C -0.424460 0.923245 0.000005
C 1.049117 0.696953 0.000130
C -1.055587 -0.356343 0.000146
C 1.288623 -0.713037 0.000226
C -0.038343 -1.424708 0.000039
C -2.467136 -0.506939 0.000188
C -1.192111 2.094464 -0.000140
C 2.131707 1.593212 0.000161
C 2.588760 -1.239224 0.000296
C -3.249501 0.699707 -0.000053
C -2.615544 1.953686 -0.000219
C 3.451472 1.064696 0.000255
C 3.681565 -0.332548 0.000315
H -0.735224 3.088818 -0.000190
H 1.973140 2.677318 0.000110
H 2.745555 -2.323063 0.000282
H -4.344166 0.637356 -0.000040
H -3.238869 2.855755 -0.000315
H 4.306305 1.750724 0.000285
H 4.708963 -0.712442 0.000365
H -4.030824 -1.903861 0.000489
H -2.388820 -2.573193 0.001166


