%chk=000259058.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000259058

0 1
O 0.906134 0.175418 -0.132590
O -0.008715 2.260611 -0.216619
N -1.293526 0.379437 -0.764821
C -1.388197 -1.109286 -0.594278
C -2.107550 -1.461722 0.726993
C -3.443779 -0.725918 0.886778
C -3.270491 0.789256 0.722705
C -2.578137 1.124627 -0.606960
C -2.089359 -1.706196 -1.818083
C -0.146163 1.056628 -0.327900
C 2.211183 0.805779 0.113995
C 3.162143 -0.383254 0.181610
C 4.598240 0.081296 0.452620
C 5.563254 -1.099276 0.522021
H -0.337814 -1.514969 -0.553460
H -1.441890 -1.212066 1.577000
H -2.268876 -2.554231 0.779114
H -3.876808 -0.949536 1.880275
H -4.172749 -1.104216 0.143986
H -4.252196 1.296029 0.770139
H -2.678796 1.196582 1.566508
H -3.223253 0.849483 -1.470266
H -2.378062 2.219230 -0.682254
H -1.621770 -1.357189 -2.748427
H -2.030311 -2.799611 -1.805810
H -3.149069 -1.432336 -1.866662
H 2.135663 1.370950 1.057979
H 2.421835 1.497091 -0.719417
H 3.110573 -0.957964 -0.765132
H 2.825669 -1.088377 0.967907
H 4.638617 0.653004 1.401268
H 4.924449 0.784036 -0.340090
H 5.292702 -1.797247 1.322810
H 5.576893 -1.666772 -0.415854
H 6.588058 -0.761190 0.714716


%chk=000259058-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000259058

0 1
O 0.962017 0.085446 -0.079366
O 0.068437 2.256400 -0.182053
N -1.331384 0.364195 -0.176582
C -1.480852 -1.119780 -0.199106
C -2.598040 -1.540153 0.795069
C -3.912256 -0.747595 0.599481
C -3.633644 0.770406 0.689313
C -2.554128 1.186508 -0.331199
C -1.723542 -1.635047 -1.640041
C -0.109083 1.005618 -0.152616
C 2.310957 0.709266 -0.017892
C 3.322771 -0.428593 0.125951
C 4.774850 0.101608 0.195133
C 5.809816 -1.032862 0.352573
H -0.523111 -1.534765 0.152436
H -2.230992 -1.369748 1.826690
H -2.779047 -2.626803 0.686542
H -4.651814 -1.051538 1.363964
H -4.359169 -0.984699 -0.387061
H -4.555551 1.351764 0.497027
H -3.286194 1.025049 1.709765
H -2.952551 1.069739 -1.361370
H -2.257634 2.240003 -0.204950
H -0.896815 -1.321382 -2.301296
H -1.767741 -2.739585 -1.645045
H -2.669744 -1.257227 -2.067127
H 2.344600 1.406836 0.839687
H 2.474917 1.296236 -0.941023
H 3.217688 -1.122315 -0.730861
H 3.092028 -1.008483 1.040692
H 4.869153 0.808510 1.044422
H 4.999277 0.683882 -0.721533
H 5.626251 -1.610340 1.278018
H 5.758730 -1.737860 -0.498441
H 6.839702 -0.634590 0.400599


