%chk=000096920.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000096920

0 1
 O   -1.764900      -1.521700      6.3999998E-03
 N    4.332800      0.3604000     -4.9999999E-03
 N   -4.760400      0.2161000     -1.5600000E-02
 C   0.1682000     -0.1848000      2.7000001E-03
 C   0.7027000       1.103600      3.4000000E-03
 C    1.016600      -1.292000     -1.0000000E-03
 C    2.934300      0.1776000     -3.4000000E-03
 C   -1.273900     -0.3737000      7.1000000E-03
 C    2.085800       1.284700      1.9999999E-04
 C    2.399700      -1.110700     -4.0000002E-03
 C   -2.207500      0.8478000      1.2500000E-02
 C   -3.633500      0.4926000     -3.4000000E-03
 H   8.2300000E-02   1.994000      7.4999998E-03
 H   0.6252000      -2.305900     -1.2000001E-03
 H    2.490900       2.293500      1.3000000E-03
 H    3.050500      -1.981400     -6.3999998E-03
 H   -2.003000       1.436200      0.9137000    
 H   -1.991100       1.454200     -0.8737000    
 H    4.948300     -0.4421000     -9.8000001E-03
 H    4.721200       1.294200     -6.6999998E-03


%chk=000096920-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000096920

0 1
O -1.802884 -1.589023 0.001105
N 4.366306 0.357374 -0.003231
N -4.840681 0.241112 0.004281
C 0.147634 -0.169024 0.001611
C 0.723866 1.134521 0.004111
C 1.029949 -1.290106 -0.002585
C 2.989992 0.186204 -0.001666
C -1.313940 -0.423749 0.003184
C 2.114218 1.315239 0.002573
C 2.418241 -1.125211 -0.004243
C -2.245331 0.823423 0.006228
C -3.674572 0.487330 0.005492
H 0.087306 2.026155 0.007354
H 0.584400 -2.290580 -0.004493
H 2.536689 2.327087 0.004632
H 3.076620 -2.002200 -0.007539
H -2.022022 1.443595 0.896397
H -2.022124 1.448251 -0.880652
H 4.991564 -0.444113 -0.006393
H 4.778970 1.286316 -0.001564


