%chk=000008557.chk
%nprocshared=24
%mem=100GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000008557

0 1
 O  -0.3576000      -2.648200      5.0000002E-04
 O   0.3570000       2.648400     -1.5000000E-03
 N   -5.059400     -0.7299000      7.9999998E-04
 N    5.059500      0.7297000      1.8000000E-03
 C   -1.355000     -0.5215000     -5.0000002E-04
 C    1.355100      0.5215000     -3.0000001E-04
 C   -1.168000      0.8624000     -3.0000001E-04
 C    1.168100     -0.8624000     -7.9999998E-04
 C  -0.1939000      -1.434400     -6.0000003E-04
 C   0.1939000       1.434500     -3.9999999E-04
 C   -2.651100      -1.050800     -1.9999999E-04
 C    2.651200       1.050900      5.0000002E-04
 C   -2.277100       1.716900      1.9999999E-04
 C    2.277200      -1.716900     -8.9999998E-04
 C   -3.753500     -0.1958000      6.0000003E-04
 C    3.753600      0.1957000      5.0000002E-04
 C   -3.566900       1.185100      7.9999998E-04
 C    3.567000      -1.185200     -9.9999997E-05
 H   -2.810200      -2.126800     -3.9999999E-04
 H    2.810400       2.126800      1.1000000E-03
 H   -2.158200       2.797000      3.9999999E-04
 H    2.158200      -2.797000     -1.3000000E-03
 H   -4.419400       1.859800      1.3000000E-03
 H    4.419400      -1.859800       0.000000    
 H   -5.196700      -1.731800      1.2000001E-03
 H   -5.859200     -0.1111000      1.9000000E-03
 H    5.859300      0.1108000      1.2000001E-03
 H    5.196800       1.731700      1.7000000E-03


%chk=000008557-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000008557

0 1
O -0.383850 -2.744244 -0.000128
O 0.383852 2.744226 0.000459
N -5.084494 -0.735132 0.000090
N 5.084534 0.735099 0.000492
C -1.361942 -0.528993 0.000300
C 1.361981 0.528969 0.000381
C -1.160420 0.886369 0.000456
C 1.160454 -0.886393 0.000117
C -0.198624 -1.482793 0.000165
C 0.198654 1.482775 0.000380
C -2.663670 -1.062311 0.000176
C 2.663710 1.062281 0.000505
C -2.297477 1.736652 0.000595
C 2.297511 -1.736680 -0.000102
C -3.800880 -0.204440 0.000246
C 3.800918 0.204404 0.000343
C -3.597596 1.211879 0.000499
C 3.597632 -1.211913 -0.000068
H -2.773530 -2.152930 0.000021
H 2.773586 2.152898 0.000637
H -2.130569 2.818541 0.000697
H 2.130594 -2.818567 -0.000360
H -4.463272 1.885593 0.000615
H 4.463314 -1.885628 -0.000330
H -5.229126 -1.741169 0.000231
H -5.899211 -0.127664 0.000434
H 5.899254 0.127638 -0.000039
H 5.229164 1.741132 0.000389


