%chk=000021389.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000021389

0 1
 O  -0.7164000      0.8196000     -3.5000001E-03
 N   -6.828700      0.5692000      1.7000000E-03
 N    7.041700      0.7798000      1.3000000E-03
 N   -4.946400       1.829700     -3.9999999E-04
 N    6.163000      -1.308200      7.9999998E-04
 N   -1.063900      -1.497300     -1.4000000E-03
 N    1.090700     -0.6648000     -1.9000000E-03
 C   -7.386600       1.888000      8.8000000E-03
 C    8.233000     -1.4800000E-02  9.4999997E-03
 C   -5.463600      0.6240000      5.0000002E-04
 C    5.931800     -1.6700000E-02  6.0000003E-04
 C   -6.120800       2.749200     -4.0000002E-03
 C    7.649500      -1.430300     -2.4000001E-03
 C   -4.637200     -0.5725000      6.9999998E-04
 C    4.583600      0.5280000       0.000000    
 C   -3.246900     -0.4606000     -1.0000000E-03
 C    3.484000     -0.3301000     -1.1000000E-03
 C   -2.454700      -1.608700     -1.6000000E-03
 C    2.206400      0.2052000     -2.4000001E-03
 C   -5.235500      -1.832600      1.7000000E-03
 C    4.390200       1.909600     -1.9999999E-04
 C   -3.053100      -2.868700     -5.0000002E-04
 C    1.997600       1.574500     -2.6000000E-03
 C   -4.443500      -2.980800      1.1000000E-03
 C    3.097200       2.432800     -1.5000000E-03
 C  -0.2714000     -0.3236000     -2.3000001E-03
 H   -7.983200       2.063900      0.9086000    
 H   -8.004500       2.066700     -0.8759000    
 H    8.827700      0.1671000      0.9093000    
 H    8.847600      0.1750000     -0.8752000    
 H   -6.085600       3.381700     -0.8975000    
 H   -6.079200       3.399100      0.8764000    
 H    7.968200      -1.978500     -0.8953000    
 H    7.972100      -1.995300      0.8785000    
 H   -7.410400     -0.2586000      4.6999999E-03
 H    7.072200       1.791100      3.5000001E-03
 H   -2.830600      0.5353000     -1.5000000E-03
 H    3.614900      -1.409200     -7.9999998E-04
 H   -6.311900      -1.968700      2.7999999E-03
 H    5.214400       2.615200      5.0000002E-04
 H   -2.448200      -3.772000     -6.0000003E-04
 H    1.032600       2.058500     -3.4000000E-03
 H   -4.908800      -3.962200      1.9000000E-03
 H    2.947400       3.508700     -1.7000000E-03
 H  -0.5552000      -2.377900     -8.9999998E-04
 H    1.311000      -1.657600     -1.1000000E-03


%chk=000021389-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000021389

0 1
O -0.711706 0.901375 -0.005048
N -6.986776 0.496806 0.003285
N 7.186694 0.716228 0.001228
N -5.120017 1.835411 0.000036
N 6.168971 -1.342919 0.002979
N -1.030178 -1.436602 -0.003445
N 1.134303 -0.568924 -0.003414
C -7.597917 1.842092 0.011522
C 8.358701 -0.183969 0.011560
C -5.589661 0.598253 0.001212
C 6.003571 -0.028041 0.001082
C -6.307999 2.751592 -0.000273
C 7.648816 -1.593568 0.002970
C -4.718137 -0.604800 -0.000162
C 4.669552 0.621816 -0.001606
C -3.313440 -0.410974 -0.001390
C 3.524812 -0.207436 -0.001434
C -2.449409 -1.532379 -0.002425
C 2.222266 0.347691 -0.003668
C -5.260558 -1.916231 -0.000139
C 4.505550 2.031703 -0.004174
C -2.998597 -2.846565 -0.002321
C 2.057653 1.760882 -0.006119
C -4.393037 -3.029837 -0.001250
C 3.204964 2.580096 -0.006399
C -0.241184 -0.270421 -0.004813
H -8.215975 2.003332 0.915908
H -8.235097 2.006189 -0.878667
H 8.979484 -0.032643 0.915526
H 8.997821 -0.030285 -0.878828
H -6.267439 3.397361 -0.896410
H -6.259530 3.410290 0.885770
H 7.918615 -2.183665 -0.892033
H 7.917994 -2.194810 0.890478
H -7.521535 -0.366128 0.009235
H 7.249773 1.729658 0.004580
H -2.917808 0.605884 -0.001600
H 3.690319 -1.292057 0.000488
H -6.342347 -2.087203 0.000387
H 5.369317 2.705650 -0.004703
H -2.333343 -3.720224 -0.003182
H 1.053080 2.185979 -0.007731
H -4.803921 -4.045061 -0.001329
H 3.076240 3.668008 -0.008402
H -0.546602 -2.337150 -0.003390
H 1.414218 -1.552205 -0.001694


