%chk=000286002.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000286002

0 1
O -1.089999 -1.735787 -1.872112
O -0.523732 0.382433 -2.334905
N -5.356761 0.559331 0.307185
C 2.150182 0.246045 0.012098
C 1.143965 -0.754380 0.242662
C 3.495604 -0.056550 0.352089
C -0.278243 -0.470380 -0.058227
C 1.483595 -1.985935 0.759891
C 1.849444 1.530080 -0.544980
C 3.817700 -1.342472 0.891244
C 4.510070 0.932847 0.146086
C 2.836804 -2.282205 1.084354
C -1.178532 -0.198410 0.895509
C 2.841720 2.458475 -0.733886
C 4.189834 2.158527 -0.380096
C -2.610766 0.062100 0.670268
C -0.617356 -0.493528 -1.511034
C -3.201340 1.216976 1.206845
C -3.407880 -0.840482 -0.048440
C -4.572899 1.428693 0.997420
C -4.773732 -0.555825 -0.203768
H 0.723493 -2.750343 0.923702
H 0.819666 1.752877 -0.836261
H 4.855918 -1.558631 1.141663
H 5.537247 0.690132 0.414118
H 3.073690 -3.265801 1.488334
H -0.865894 -0.148953 1.947964
H 2.616566 3.434939 -1.161533
H 4.954836 2.917066 -0.540062
H -2.610841 1.939266 1.765464
H -2.973664 -1.744876 -0.478498
H -5.076104 2.320076 1.391452
H -5.435493 -1.234945 -0.755034
H -1.292199 -1.796559 -2.846413


%chk=000286002-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000286002

0 1
O 0.440527 -1.471112 -2.183577
O -1.350219 -0.034084 -2.441876
N -5.662830 0.342905 0.758076
C 2.183229 0.242311 -0.136704
C 1.071621 -0.559913 0.327897
C 3.506307 -0.015136 0.397542
C -0.315143 -0.359969 -0.212537
C 1.291573 -1.540165 1.307399
C 2.027787 1.308423 -1.084568
C 3.684758 -1.040223 1.384530
C 4.614218 0.773075 -0.059604
C 2.594665 -1.782318 1.838610
C -1.330694 -0.077197 0.680185
C 3.124588 2.062531 -1.508778
C 4.432616 1.789547 -0.998783
C -2.796289 0.071118 0.601827
C -0.500140 -0.563707 -1.680427
C -3.495335 0.043373 1.848590
C -3.591545 0.260781 -0.566839
C -4.897526 0.173661 1.879291
C -4.991233 0.384927 -0.433412
H 0.451464 -2.159681 1.640149
H 1.030096 1.551099 -1.466610
H 4.690760 -1.228686 1.777900
H 5.610680 0.566279 0.348942
H 2.731435 -2.565702 2.591637
H -0.968122 0.014285 1.715787
H 2.983935 2.874228 -2.230887
H 5.284764 2.387169 -1.340269
H -2.944230 -0.086973 2.787415
H -3.123770 0.332817 -1.549825
H -5.442149 0.148557 2.829796
H -5.616227 0.531645 -1.321498
H 0.305327 -1.560066 -3.166277


