%chk=000090619.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000090619

0 1
 O    3.011300      -2.357900     -1.3000000E-03
 O   0.8238000      -2.542700     -9.9999997E-05
 O   -4.234500      2.4000001E-03  3.9999999E-04
 O   -3.074400      -1.861200      3.9999999E-04
 N    1.866900      -1.850500     -3.0000001E-04
 N   -3.138300     -0.6082000      3.0000001E-04
 C   0.4990000      0.2146000      3.0000001E-04
 C   0.4500000       1.629000     -1.9999999E-04
 C    1.747000     -0.4294000      8.9999998E-04
 C  -0.7016000     -0.5141000      1.9999999E-04
 C  -0.7979000       2.273100     -7.9999998E-04
 C   -1.932700      0.1423000     -3.0000001E-04
 C    1.650600       2.357700     -9.9999997E-05
 C   -1.980700       1.533200     -7.9999998E-04
 C    2.929800      0.3104000      1.0000000E-03
 C    2.881700       1.701300      5.0000002E-04
 H  -0.8153000      -1.578300      1.6000000E-03
 H  -0.8589000       3.359400     -1.1000000E-03
 H    1.637000       3.445700     -5.0000002E-04
 H   -2.921300       2.078200     -1.2000001E-03
 H    3.912400     -0.1547000      1.3000000E-03
 H    3.802500       2.277400      6.0000003E-04


%chk=000090619-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000090619

0 1
O 3.222496 -2.358300 -0.000995
O 0.983375 -2.718072 0.001371
O -4.345443 0.115961 -0.000222
O -3.207461 -1.860432 0.000061
N 2.004288 -1.928028 0.000816
N -3.252819 -0.573430 -0.000206
C 0.475625 0.159882 0.000242
C 0.439993 1.616891 -0.000068
C 1.789677 -0.448962 0.000462
C -0.773834 -0.542908 0.000189
C -0.821461 2.300446 -0.000368
C -1.966614 0.180927 -0.000142
C 1.655004 2.374121 -0.000078
C -2.024072 1.603818 -0.000402
C 2.961098 0.317879 0.000387
C 2.895943 1.737304 0.000149
H -0.800310 -1.631834 0.000427
H -0.820445 3.395734 -0.000597
H 1.592050 3.467889 -0.000279
H -2.995539 2.102752 -0.000632
H 3.922134 -0.202280 0.000530
H 3.822717 2.318342 0.000154


