%chk=000063257.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000063257

0 1
 O   -1.605900       3.145500     -6.8800002E-02
 O    4.992800      4.1999999E-02  -1.897400    
 N   -2.124300      0.9005000     -3.3100002E-02
 N   0.1336000       1.713600      7.3500000E-02
 C   -3.559800       1.161000     -0.1063000    
 C   -1.660300     -0.4456000      1.6000000E-03
 C  -0.2848000     -0.6828000      7.0299998E-02
 C   0.5920000      0.5037000      0.1257000    
 C   -2.531600      -1.545300     -4.4199999E-02
 C   -1.216900       1.976600     -1.4300000E-02
 C   -3.866800       1.923500      -1.388400    
 C   -3.997900       1.945000       1.124000    
 C   0.2156000      -1.991500      6.5200001E-02
 C   -2.033900      -2.849900     -3.4000002E-02
 C    2.054900      0.3537000      0.2492000    
 C  -0.6623000      -3.072300      1.6400000E-02
 C   -2.974000      -4.007000     -8.3700001E-02
 C    2.838000      0.2673000     -0.8967000    
 C    2.637900      0.3012000       1.510700    
 C    4.220800      0.1268000     -0.7798000    
 C    4.020800      0.1607000       1.627600    
 C    4.812200      7.3399998E-02  0.4824000    
 H   -4.174400      0.2673000     -0.1302000    
 H   -3.609100      -1.463000     -9.4300002E-02
 H   -4.951900       1.978300      -1.536200    
 H   -3.506100       2.955000      -1.394100    
 H   -3.443700       1.412500      -2.260600    
 H   -3.695600       1.429900       2.042800    
 H   -5.090400       2.033800       1.141100    
 H   -3.603000       2.963300       1.166600    
 H    1.280900      -2.197500      0.1057000    
 H  -0.2609000      -4.082200      1.7899999E-02
 H   -3.815900      -3.851200      0.5995000    
 H   -3.359700      -4.134800      -1.100100    
 H   -2.483800      -4.939200      0.2171000    
 H    2.380500      0.3087000      -1.882100    
 H    2.029800      0.3685000       2.408800    
 H    4.481100      0.1192000       2.610400    
 H    5.888300     -3.5799999E-02  0.5871000    
 H    5.923600     -5.1600002E-02  -1.631100    


%chk=000063257-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000063257

0 1
O -1.768275 2.968763 1.140852
O 4.740401 -1.342836 -1.626666
N -2.106060 0.890633 0.088877
N 0.117243 1.676021 0.649469
C -3.522217 1.249446 -0.277832
C -1.655050 -0.441666 0.029238
C -0.252350 -0.700337 0.235426
C 0.618399 0.460799 0.410843
C -2.536671 -1.542590 -0.185827
C -1.270138 1.903621 0.678485
C -3.589941 2.550012 -1.109243
C -4.425340 1.296138 0.976036
C 0.196766 -2.051905 0.280928
C -2.068048 -2.869977 -0.173174
C 2.108351 0.379922 0.328742
C -0.685897 -3.117950 0.078237
C -3.019988 -4.030322 -0.394471
C 2.760409 -0.473319 -0.596334
C 2.882814 1.237571 1.157828
C 4.169974 -0.477098 -0.674846
C 4.288297 1.215635 1.076018
C 4.945632 0.357819 0.164016
H -3.864152 0.437327 -0.943364
H -3.607596 -1.375378 -0.324268
H -4.617742 2.665023 -1.499287
H -3.338927 3.430706 -0.500149
H -2.899021 2.504278 -1.970176
H -4.383785 0.345333 1.537807
H -5.473962 1.477570 0.677255
H -4.098979 2.113132 1.639645
H 1.249661 -2.249728 0.500097
H -0.321281 -4.150139 0.123599
H -4.064919 -3.692096 -0.495864
H -2.754826 -4.588296 -1.312561
H -2.973925 -4.749514 0.444269
H 2.199242 -1.103553 -1.291584
H 2.361759 1.915491 1.839021
H 4.882477 1.870849 1.721766
H 6.041713 0.347965 0.102205
H 5.725749 -1.256050 -1.636812


