%chk=000299964.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000299964

0 1
O 1.298364 0.292658 2.054375
O -2.673284 -2.892907 -0.161274
O -3.555402 1.856956 -0.107633
O -4.544326 -0.671893 -0.376795
N 1.904884 0.014856 -0.121971
C 3.358041 0.145897 0.205517
C 4.109202 -1.163545 -0.113843
C 3.974091 1.343294 -0.547920
C 5.595118 -1.015760 0.238360
C 5.461012 1.477898 -0.195083
C 6.226697 0.179974 -0.488390
C 1.509207 -0.273203 -1.518117
C 0.958452 0.072954 0.900997
C -0.484754 -0.120940 0.506342
C -1.298690 1.012561 0.373915
C -0.979031 -1.403813 0.319958
C -2.343275 -1.574352 -0.015545
C -2.649298 0.837315 0.058475
C -3.192277 -0.459171 -0.155594
C -4.056918 -3.238495 -0.437579
C -3.111642 3.206805 0.186865
C -5.072476 -0.012911 -1.560607
H 3.426807 0.341975 1.315371
H 4.000203 -1.428153 -1.181236
H 3.663226 -2.000124 0.456639
H 3.432743 2.271033 -0.283605
H 3.855297 1.219043 -1.640458
H 6.135172 -1.945125 -0.022272
H 5.710809 -0.893544 1.333322
H 5.569894 1.743764 0.874854
H 5.905716 2.315966 -0.763446
H 7.284093 0.289825 -0.183519
H 6.239889 -0.008992 -1.578695
H 1.238514 -1.336176 -1.643299
H 2.334180 -0.043629 -2.212906
H 0.641463 0.341088 -1.815868
H -0.879344 1.998488 0.549114
H -0.353949 -2.286891 0.441349
H -4.026405 -4.332456 -0.383371
H -4.334444 -2.882785 -1.433110
H -4.715593 -2.809028 0.327139
H -2.333057 3.511920 -0.517181
H -2.775332 3.278434 1.226248
H -4.035049 3.780121 0.034109
H -6.109324 -0.364546 -1.569989
H -4.526822 -0.331477 -2.450212
H -5.026682 1.075594 -1.430230


%chk=000299964-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000299964

0 1
O 1.221132 1.255441 1.282511
O -2.714231 -2.705002 -0.864245
O -3.809320 1.932134 0.206149
O -4.652097 -0.634966 -0.537820
N 1.945449 -0.171059 -0.412051
C 3.352137 0.033644 0.046311
C 4.198497 -1.254466 -0.083600
C 4.028968 1.230575 -0.672328
C 5.625391 -1.019053 0.471297
C 5.461080 1.456290 -0.129131
C 6.316570 0.171241 -0.236450
C 1.742456 -0.785604 -1.737233
C 0.939745 0.447611 0.331255
C -0.504875 0.135784 0.024320
C -1.439070 1.184678 0.211321
C -0.967176 -1.159245 -0.297662
C -2.347791 -1.401696 -0.481338
C -2.817075 0.952328 0.028360
C -3.289506 -0.342436 -0.355470
C -3.734032 -3.387588 -0.036430
C -3.374507 3.246068 0.693261
C -5.373187 0.165391 -1.553231
H 3.270864 0.300330 1.116830
H 4.275886 -1.558509 -1.147571
H 3.703749 -2.082186 0.460596
H 3.410714 2.134228 -0.521136
H 4.081662 1.036852 -1.764171
H 6.229267 -1.939507 0.353783
H 5.564869 -0.811003 1.559244
H 5.399711 1.765854 0.934357
H 5.944921 2.288310 -0.676255
H 7.320025 0.342829 0.198836
H 6.469209 -0.079480 -1.306997
H 1.851336 -1.886282 -1.711483
H 2.486941 -0.384199 -2.449978
H 0.739542 -0.545780 -2.118352
H -1.056697 2.154793 0.538643
H -0.287172 -2.010255 -0.391043
H -3.875224 -4.369996 -0.512402
H -4.676680 -2.816927 -0.026416
H -3.356997 -3.520831 0.996215
H -2.699108 3.740762 -0.030897
H -2.868092 3.158526 1.672790
H -4.299830 3.830897 0.800964
H -6.393770 -0.246544 -1.567191
H -4.900000 0.036758 -2.545045
H -5.387985 1.229794 -1.267916


