%chk=000001645.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000001645

0 1
 O    2.329100       1.521600      9.4999997E-03
 N   -2.759900       1.513400     -2.7999999E-03
 N    2.947900     -0.6864000     -4.4999998E-03
 C   0.5914000     -6.8099998E-02 -1.6000000E-03
 C   -1.749800      0.5286000     -3.9999999E-04
 C  -0.4070000      0.9062000     -2.4000001E-03
 C   0.2468000      -1.419800      1.2000001E-03
 C   -2.094200     -0.8232000      2.3000001E-03
 C   -1.095900      -1.797300      3.1999999E-03
 C    1.991700      0.3249000     -4.6000001E-03
 H  -0.1508000       1.963300     -5.2000000E-03
 H   0.9672000      -2.228800      2.4999999E-03
 H   -3.136900      -1.130200      3.5999999E-03
 H   -1.365300      -2.849600      5.5000000E-03
 H   -2.511400       2.493700     -2.4000001E-03
 H   -3.733500       1.239600      1.0000000E-03
 H    2.762300      -1.680900     -1.1300000E-02
 H    3.932400     -0.4382000      5.0000002E-04


%chk=000001645-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000001645

0 1
O 2.321903 1.576585 0.008892
N -2.748043 1.536849 -0.002812
N 3.022538 -0.623388 -0.006521
C 0.592919 -0.140783 0.000654
C -1.779735 0.534298 -0.000755
C -0.397442 0.864896 -0.000974
C 0.213289 -1.510356 0.003400
C -2.150842 -0.842816 0.001487
C -1.158758 -1.842257 0.003713
C 2.025827 0.339769 -0.000229
H -0.059297 1.907868 -0.002369
H 0.952317 -2.318934 0.006831
H -3.211734 -1.121600 0.001768
H -1.461973 -2.895480 0.006064
H -2.479149 2.516254 -0.003678
H -3.737672 1.309189 -0.001859
H 2.831151 -1.621299 -0.014745
H 3.988803 -0.299995 -0.004766


