%chk=000044334.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000044334

0 1
 O    5.293700       1.135600     -1.6000000E-03
 O    3.495100       2.394200     -6.9999998E-04
 N    4.050200       1.273000     -5.0000002E-04
 C  -0.3967000     -0.9055000      9.9999997E-05
 C   -1.029900      0.3718000      3.9999999E-04
 C    1.044300      -1.013700      1.9999999E-04
 C   -2.470800      0.4801000      3.0000001E-04
 C    1.827000      0.1655000      6.0000003E-04
 C   -3.253500     -0.6992000     -3.0000001E-04
 C  -0.1903000       1.504300      7.9999998E-04
 C   -1.236200      -2.038000     -3.0000001E-04
 C    1.199400       1.406800      8.9999998E-04
 C   -2.625900      -1.940500     -5.0000002E-04
 C    3.231700      0.1032000      7.9999998E-04
 C    1.761300      -2.239700     -9.9999997E-05
 C   -3.187800       1.706100      1.9999999E-04
 C   -4.658300     -0.6369000     -3.9999999E-04
 C    3.894600      -1.119000      5.0000002E-04
 C    3.158500      -2.292300      1.9999999E-04
 C   -4.585000       1.758700     -9.9999997E-05
 C   -5.321100      0.5854000     -5.0000002E-04
 H  -0.6049000       2.509700      1.4000000E-03
 H  -0.8283000      -3.045500     -6.0000003E-04
 H    1.596300       2.404300      2.3000001E-03
 H   -3.208800      -2.859800     -8.9999998E-04
 H    1.243100      -3.195200     -3.9999999E-04
 H   -2.670200       2.661700      5.0000002E-04
 H   -5.252700      -1.549000     -7.9999998E-04
 H    4.977500      -1.206800      3.9999999E-04
 H    3.663600      -3.253800     -9.9999997E-05
 H   -5.091000       2.719800     -1.9999999E-04
 H   -6.406200      0.6189000     -6.9999998E-04


%chk=000044334-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000044334

0 1
O 5.500324 1.006548 -0.000020
O 3.777248 2.476634 0.001224
N 4.231594 1.265619 0.000423
C -0.410871 -0.886172 -0.000070
C -1.061989 0.390195 0.000100
C 1.052673 -0.960602 -0.000002
C -2.521699 0.477080 0.000015
C 1.846758 0.258753 0.000238
C -3.297075 -0.739660 -0.000220
C -0.239442 1.567285 0.000353
C -1.228786 -2.075761 -0.000311
C 1.146187 1.518194 0.000422
C -2.611439 -2.004777 -0.000377
C 3.285843 0.111777 0.000231
C 1.721920 -2.222607 -0.000168
C -3.230309 1.720533 0.000152
C -4.725738 -0.678611 -0.000301
C 3.907283 -1.147722 0.000044
C 3.118027 -2.319042 -0.000141
C -4.630241 1.759601 0.000068
C -5.388790 0.552084 -0.000158
H -0.710504 2.554008 0.000516
H -0.762423 -3.063892 -0.000450
H 1.723179 2.440591 0.000639
H -3.208734 -2.924136 -0.000557
H 1.141340 -3.147826 -0.000325
H -2.682854 2.667155 0.000320
H -5.294172 -1.616040 -0.000481
H 4.998456 -1.194209 0.000040
H 3.603323 -3.299629 -0.000261
H -5.147237 2.725288 0.000175
H -6.483152 0.593544 -0.000220


