%chk=000246555.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000246555

0 1
O 4.135790 1.503203 1.372216
O 4.894422 -0.590272 1.263000
O -0.719732 -2.063862 -0.278702
N -1.455469 0.110020 -0.500103
C 1.687763 0.347845 0.101656
C 3.183378 0.155458 -0.372683
C 0.892334 -0.408092 -1.013531
C 3.215779 -1.271386 -0.977679
C 1.787820 -1.590940 -1.442763
C 1.476842 -0.319058 1.467103
C 1.289998 1.821688 0.195598
C 3.638546 1.187198 -1.408955
C 4.150739 0.243135 0.803499
C -0.476144 -0.904852 -0.552397
C -2.825406 -0.046508 -0.106379
C -3.647187 1.110640 -0.021973
C -3.362565 -1.311165 0.185022
C -4.987068 0.957042 0.351789
C -3.122562 2.479979 -0.320294
C -4.702576 -1.433560 0.556428
C -5.517765 -0.303725 0.640611
H 0.761355 0.272003 -1.888787
H 3.558864 -2.009235 -0.224238
H 3.939691 -1.344343 -1.806390
H 1.738766 -1.743513 -2.533432
H 1.428717 -2.538410 -0.986954
H 0.426392 -0.285364 1.783214
H 1.761772 -1.379821 1.455389
H 2.050890 0.175371 2.259568
H 0.322826 1.951671 0.693000
H 2.028499 2.373942 0.801468
H 1.241995 2.315713 -0.778482
H 4.642806 0.959316 -1.788822
H 2.964628 1.206290 -2.272906
H 3.677446 2.200521 -0.985917
H -1.165526 1.065720 -0.718305
H 4.773305 1.581659 2.130675
H -2.732872 -2.206654 0.124091
H -5.629231 1.834604 0.419938
H -2.776341 2.563898 -1.359732
H -3.893715 3.253210 -0.189566
H -2.296189 2.753753 0.349896
H -5.108206 -2.419570 0.780475
H -6.561614 -0.400651 0.929654


%chk=000246555-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000246555

0 1
O 4.381939 1.598157 1.252467
O 5.038766 -0.608916 1.078433
O -0.681282 -2.114695 -0.023700
N -1.495859 0.041799 -0.481295
C 1.739092 0.237667 0.292165
C 3.195379 0.225650 -0.381736
C 0.886743 -0.410602 -0.872772
C 3.249839 -1.152507 -1.114459
C 1.779120 -1.531628 -1.465249
C 1.725410 -0.661815 1.557682
C 1.231094 1.647402 0.672141
C 3.393946 1.387882 -1.395758
C 4.285927 0.310100 0.687047
C -0.490095 -0.926798 -0.422226
C -2.870681 -0.052569 -0.113860
C -3.672082 1.125776 -0.257781
C -3.442909 -1.256494 0.375869
C -5.037742 1.055500 0.098846
C -3.078330 2.424748 -0.780215
C -4.809952 -1.290404 0.722413
C -5.615490 -0.138589 0.587192
H 0.727310 0.379521 -1.636156
H 3.711757 -1.909758 -0.459808
H 3.885867 -1.079328 -2.014378
H 1.620110 -1.628580 -2.553545
H 1.490823 -2.493636 -1.008073
H 0.698894 -0.763981 1.949844
H 2.103531 -1.677910 1.356329
H 2.345462 -0.214971 2.356420
H 0.263059 1.573822 1.201955
H 1.947254 2.150304 1.344788
H 1.090757 2.295050 -0.213879
H 4.387602 1.306765 -1.872688
H 2.637825 1.331667 -2.198830
H 3.331291 2.374383 -0.910904
H -1.194909 0.956080 -0.824575
H 5.100499 1.585214 1.942367
H -2.811472 -2.140991 0.474275
H -5.656682 1.954420 -0.008647
H -2.686479 2.321512 -1.812679
H -3.843692 3.217562 -0.806448
H -2.251515 2.796204 -0.140586
H -5.242238 -2.224134 1.098768
H -6.676689 -0.165982 0.856544


