%chk=000246357.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000246357

0 1
O 0.483424 -0.217521 2.114109
O 0.269719 2.968001 -1.024951
N -0.102005 0.946151 0.108431
C 0.740997 -0.151860 0.714311
C 2.164029 0.352116 0.456776
C 2.118995 1.592386 -0.220110
C 0.472703 -1.530845 0.149862
C 0.696314 1.986742 -0.465536
C -1.538370 0.881152 0.071187
C 3.369475 -0.230062 0.798949
C 3.278017 2.265803 -0.564736
C 0.358424 -1.708232 -1.236085
C 0.369966 -2.631340 1.011719
C 4.553515 0.452518 0.450524
C -2.261130 1.677941 -0.835633
C -2.223315 0.020861 0.950283
C 4.509650 1.675481 -0.217801
C 0.143002 -2.987504 -1.755530
C 0.154441 -3.907839 0.485688
C -3.653440 1.606470 -0.859541
C -3.614826 -0.043719 0.909678
C -4.344737 0.746749 0.007765
C 0.041557 -4.087069 -0.896774
C -5.836058 0.662795 -0.037696
H 3.407507 -1.185946 1.319891
H 3.237496 3.221868 -1.088169
H 0.562320 0.668108 2.537985
H 0.429764 -0.852214 -1.907758
H 0.451480 -2.483438 2.091420
H 5.516335 0.010440 0.709966
H -1.743105 2.362712 -1.512837
H -1.673731 -0.596125 1.664941
H 5.436844 2.186061 -0.478764
H 0.050572 -3.125945 -2.831723
H 0.071640 -4.762611 1.154930
H -4.205268 2.228353 -1.563173
H -4.137096 -0.715611 1.589008
H -0.127857 -5.082367 -1.304935
H -6.268322 0.410049 0.939305
H -6.295943 1.607799 -0.355665
H -6.159682 -0.112207 -0.748012


%chk=000246357-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000246357

0 1
O 0.462918 -0.187618 2.195663
O 0.319710 2.985856 -1.125608
N -0.108790 0.947200 0.079358
C 0.712519 -0.125250 0.747258
C 2.142544 0.350016 0.474654
C 2.119269 1.561973 -0.238233
C 0.450216 -1.529509 0.188395
C 0.706963 1.958193 -0.503183
C -1.545558 0.906788 0.050494
C 3.355907 -0.244410 0.856573
C 3.303068 2.229976 -0.601066
C 0.211084 -1.703700 -1.196060
C 0.536501 -2.662566 1.031543
C 4.557136 0.418851 0.499980
C -2.285168 1.764644 -0.809404
C -2.254738 -0.003281 0.880330
C 4.532438 1.641918 -0.221379
C 0.051960 -2.999360 -1.730996
C 0.374199 -3.959390 0.493593
C -3.693093 1.695422 -0.832858
C -3.661350 -0.056860 0.836136
C -4.413838 0.783748 -0.022086
C 0.133946 -4.132691 -0.888395
C -5.928605 0.698218 -0.082913
H 3.374723 -1.192262 1.403904
H 3.256220 3.170807 -1.158536
H 0.739730 0.675939 2.596955
H 0.135837 -0.829327 -1.851974
H 0.709890 -2.517558 2.101508
H 5.520770 -0.020214 0.780920
H -1.761048 2.488684 -1.434702
H -1.713837 -0.649636 1.573479
H 5.476458 2.130144 -0.486544
H -0.140541 -3.124830 -2.802152
H 0.433594 -4.831988 1.153748
H -4.240713 2.370989 -1.501616
H -4.183195 -0.766240 1.490221
H 0.007933 -5.138369 -1.304824
H -6.356085 0.380900 0.884834
H -6.378391 1.670231 -0.352425
H -6.257282 -0.037335 -0.843294


