%chk=000221228.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000221228

0 1
O 0.370567 -0.357189 -1.977440
O 1.874147 -2.410209 1.869787
O 0.173223 1.444014 1.888806
N -1.272639 0.779040 0.252291
N 1.397105 -1.482999 -0.210994
C -0.805932 -0.621227 0.193688
C -0.252067 -1.237131 1.492782
C 0.359907 -0.746202 -0.835667
C 1.120507 -1.788689 1.166587
C -2.254752 1.109387 -0.819371
C 2.708373 -1.753136 -0.853256
C -0.704134 1.751810 1.098494
C -3.612685 0.506141 -0.543535
C 3.699633 -0.657523 -0.541944
C -1.240614 3.151817 1.013451
C -4.272743 -0.195702 -1.562797
C -4.228683 0.661215 0.706321
C 3.970702 0.337964 -1.490158
C 4.349110 -0.638270 0.701103
C -5.542802 -0.731826 -1.332667
C -5.496953 0.119562 0.932592
C 4.902833 1.339001 -1.200803
C 5.277603 0.365712 0.985603
C -6.156747 -0.575662 -0.085902
C 5.558404 1.352686 0.034317
H -1.658731 -1.258709 -0.176808
H -0.914938 -2.020291 1.902679
H -0.147288 -0.486247 2.320101
H -1.842422 0.753604 -1.800277
H -2.358989 2.211811 -0.935914
H 2.545425 -1.852751 -1.952822
H 3.082305 -2.738162 -0.482231
H -0.805382 3.758130 1.828051
H -0.957272 3.645809 0.073141
H -2.331517 3.206773 1.119426
H -3.801406 -0.324594 -2.536346
H -3.716260 1.194940 1.505105
H 3.450515 0.338368 -2.447451
H 4.115936 -1.401195 1.448023
H -6.054173 -1.273838 -2.127275
H -5.972224 0.240002 1.905305
H 5.114939 2.110763 -1.938239
H 5.779493 0.381471 1.951665
H -7.145609 -0.994890 0.091651
H 6.283035 2.133022 0.257824


%chk=000221228-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000221228

0 1
O 0.741889 0.207562 -2.115699
O 1.417791 -2.439255 1.692178
O 0.508083 1.837743 0.797410
N -1.427458 1.069567 -0.198575
N 1.354571 -1.209426 -0.321150
C -0.839152 -0.282041 -0.223758
C -0.503125 -0.929158 1.144971
C 0.494805 -0.338472 -1.014421
C 0.838520 -1.630878 0.928832
C -2.679676 1.269671 -0.961526
C 2.690647 -1.609058 -0.823139
C -0.643349 2.098800 0.323279
C -3.842452 0.414728 -0.458107
C 3.815589 -0.706540 -0.326453
C -1.201507 3.517360 0.320073
C -4.718088 -0.206130 -1.382096
C -4.084714 0.258375 0.930160
C 4.118394 0.499192 -1.007691
C 4.572291 -1.068622 0.815425
C -5.824656 -0.960980 -0.929557
C -5.187768 -0.496566 1.384876
C 5.165782 1.330138 -0.553406
C 5.621063 -0.237516 1.269473
C -6.062990 -1.107720 0.455876
C 5.921495 0.962634 0.584570
H -1.557728 -0.925928 -0.764003
H -1.265339 -1.644089 1.492875
H -0.355925 -0.158209 1.919472
H -2.493931 1.052374 -2.032616
H -2.952362 2.336234 -0.899055
H 2.625687 -1.581378 -1.925072
H 2.851556 -2.648816 -0.489137
H -0.507487 4.143572 0.899734
H -1.259672 3.924488 -0.706142
H -2.206546 3.581579 0.774636
H -4.534810 -0.099984 -2.458884
H -3.403117 0.724862 1.651976
H 3.522683 0.787783 -1.881863
H 4.327229 -1.992351 1.352905
H -6.493847 -1.436754 -1.654939
H -5.365154 -0.609887 2.460204
H 5.391732 2.262114 -1.083619
H 6.200575 -0.524546 2.154139
H -6.917799 -1.695212 0.808435
H 6.735072 1.607344 0.936306


