%chk=000100605.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000100605

0 1
 O   -3.973900      -1.556800      1.1000000E-03
 O   -4.351700      0.8222000      3.9999999E-04
 O   0.3435000       3.053000      8.9999998E-04
 N    1.769400       1.319000     -3.9999999E-04
 C    1.966600     -4.2399999E-02 -5.0000002E-04
 C   0.9610000      -1.017900     -1.1000000E-03
 C  -0.4330000     -0.5267000     -1.4000000E-03
 C  -0.6882000      0.8889000     -1.5000000E-03
 C    3.329400     -0.2893000      6.9999998E-04
 C   0.4726000       1.838200     -8.9999998E-04
 C   -1.538200      -1.393900     -6.0000003E-04
 C   -1.986500       1.412000     -1.2000001E-03
 C    2.983700       1.954600      6.9999998E-04
 C   -2.810100     -0.8488000     -1.9999999E-04
 C   -3.026800      0.5094000     -6.9999998E-04
 C    1.417600      -2.343600     -8.9999998E-04
 C    3.966800      0.9836000      1.6000000E-03
 C    3.756600      -1.628000      1.0000000E-03
 C    2.786800      -2.641500      1.9999999E-04
 C   -4.945500     -0.4916000      2.6000000E-03
 H   -1.423400      -2.472700     -9.9999997E-05
 H   -2.179300       2.478900     -1.1000000E-03
 H    3.055400       3.033800      1.0000000E-03
 H   0.7164000      -3.174100     -1.3000000E-03
 H    5.031200       1.175000      2.6000000E-03
 H    4.812400      -1.881300      2.0000001E-03
 H    3.105600      -3.681200      5.0000002E-04
 H   -5.578300     -0.5924000     -0.8867000    
 H   -5.574300     -0.5912000      0.8949000    


%chk=000100605-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000100605

0 1
O -4.039897 -1.558361 -0.000894
O -4.409542 0.815813 -0.000663
O 0.291937 3.149922 -0.000645
N 1.761557 1.326372 0.001771
C 1.979918 -0.055130 0.001040
C 0.966605 -1.028906 0.001800
C -0.418771 -0.535466 0.001818
C -0.644118 0.890138 0.002109
C 3.382375 -0.300987 -0.000349
C 0.459959 1.895752 0.004340
C -1.535398 -1.427081 0.000962
C -1.967820 1.428631 0.001209
C 3.022054 1.975995 -0.000470
C -2.808948 -0.870756 0.000266
C -3.024093 0.530750 0.000354
C 1.424528 -2.374699 0.001466
C 4.022972 1.013704 -0.001510
C 3.805629 -1.652372 -0.000449
C 2.813994 -2.667361 0.000497
C -5.094258 -0.503692 -0.000356
H -1.399542 -2.510600 0.000668
H -2.102748 2.512878 0.001572
H 3.068134 3.062395 -0.000539
H 0.710383 -3.204807 0.001773
H 5.092666 1.216744 -0.002811
H 4.868083 -1.917127 -0.001441
H 3.127682 -3.716984 0.000192
H -5.694208 -0.599743 -0.920827
H -5.693332 -0.599823 0.920717


