%chk=000205919.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000205919

0 1
O 0.274329 0.521024 1.967067
O -2.349403 -2.933024 0.131033
O 1.666646 -1.873550 -1.734851
N 0.996977 -0.567528 0.078646
N -0.353579 -2.379141 -0.792973
C -1.372646 -0.851385 0.888417
C 0.007921 -0.231124 1.065091
C -2.297320 0.178406 0.268638
C -1.445474 -2.135370 0.082974
C 2.265086 0.166697 0.079075
C 0.842972 -1.610148 -0.889410
C -2.050124 0.667906 -1.022641
C -3.402631 0.637899 0.997205
C 2.236806 1.567636 0.008794
C 3.474958 -0.538931 0.150976
C -2.911472 1.615779 -1.580264
C -4.259482 1.586951 0.431097
C -4.016094 2.076454 -0.855586
C 3.446916 2.265818 0.015647
C 4.673578 0.179206 0.149726
C 4.662236 1.576397 0.084215
H -1.742937 -1.101764 1.930029
H -0.416986 -3.195975 -1.424691
H -1.193643 0.315564 -1.595736
H -3.600144 0.261518 2.000527
H 1.290411 2.105205 -0.032379
H 3.484936 -1.627659 0.188071
H -2.721131 1.995885 -2.583922
H -5.119685 1.944181 0.997187
H -4.685918 2.815265 -1.294040
H 3.439890 3.354632 -0.032634
H 5.621381 -0.356689 0.200187
H 5.600926 2.128361 0.086625


%chk=000205919-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000205919

0 1
O 0.259293 0.278231 2.101576
O -2.357881 -3.106013 0.035089
O 1.697628 -1.843513 -1.831133
N 0.975958 -0.634667 0.063674
N -0.339218 -2.410909 -0.873813
C -1.395994 -0.993873 0.845446
C 0.005813 -0.413974 1.088834
C -2.281739 0.112331 0.232514
C -1.429754 -2.262098 -0.000402
C 2.210837 0.146645 0.090072
C 0.835669 -1.626824 -0.946053
C -2.166991 0.481078 -1.131970
C -3.198385 0.799473 1.064137
C 2.127145 1.549972 -0.036021
C 3.456476 -0.496291 0.248239
C -2.966831 1.520293 -1.655734
C -3.995793 1.840061 0.538343
C -3.882562 2.203666 -0.822954
C 3.309568 2.319465 -0.001834
C 4.635389 0.279990 0.273496
C 4.565025 1.686772 0.150555
H -1.804673 -1.250944 1.836141
H -0.369216 -3.196352 -1.533004
H -1.468354 -0.041267 -1.795919
H -3.285142 0.523546 2.120793
H 1.150527 2.031755 -0.150678
H 3.505467 -1.585638 0.337738
H -2.876165 1.794483 -2.712486
H -4.703641 2.363521 1.190003
H -4.502473 3.009082 -1.231466
H 3.249749 3.408917 -0.095363
H 5.605658 -0.214079 0.390539
H 5.481914 2.285659 0.173739


