%chk=000205686.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000205686

0 1
O 4.021828 -0.882422 -0.252878
N -0.609752 0.778653 -1.206535
N 2.149573 0.158780 0.635915
N 3.341179 -1.533071 1.846407
C -1.439739 0.210448 -0.081453
C 0.680182 0.046370 -1.416981
C 1.809361 0.803649 -0.661999
C -2.753696 1.019381 0.024493
C -1.772579 -1.267576 -0.388587
C -0.196194 2.203700 -0.967054
C 1.241850 2.218412 -0.407659
C -3.667408 0.436406 1.108874
C -2.682168 -1.858873 0.694575
C -3.974235 -1.043984 0.844044
C 3.226398 -0.754265 0.665050
H -0.899370 0.266824 0.897201
H 0.881912 0.061755 -2.510761
H 0.616968 -1.021646 -1.131678
H 2.740795 0.842524 -1.284543
H -0.903416 2.737453 -0.303476
H -0.238149 2.711742 -1.954896
H -3.268922 1.011446 -0.956636
H -2.535935 2.082401 0.243475
H -0.843470 -1.864737 -0.471751
H -2.263908 -1.334521 -1.379860
H 1.860052 2.980286 -0.910907
H 1.257702 2.485008 0.662861
H -4.610216 1.013734 1.151328
H -3.194891 0.549772 2.103081
H -2.146170 -1.894201 1.661947
H -2.926557 -2.908308 0.443032
H -4.590054 -1.456405 1.664169
H -4.583185 -1.139427 -0.075916
H 1.367277 0.032743 1.275984
H 2.973781 -1.188137 2.719117
H 4.220255 -2.029815 1.950218


%chk=000205686-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000205686

0 1
O 3.514119 -1.397376 -0.429978
N -0.596101 0.940203 -1.230219
N 1.965881 0.059641 0.547361
N 2.862489 -1.735754 1.786415
C -1.379825 0.347130 -0.095509
C 0.682583 0.289909 -1.628970
C 1.795265 0.857335 -0.682578
C -2.821415 0.923220 -0.124791
C -1.445770 -1.198218 -0.156485
C -0.168208 2.351919 -0.988676
C 1.275046 2.293808 -0.361236
C -3.700155 0.363220 1.017567
C -2.333315 -1.778328 0.972845
C -3.758320 -1.180550 0.962515
C 2.818662 -1.041086 0.572184
H -0.931387 0.621049 0.901037
H 0.912284 0.607030 -2.666485
H 0.633412 -0.806950 -1.620364
H 2.772901 0.857676 -1.193223
H -0.886785 2.883158 -0.343593
H -0.129891 2.883847 -1.958632
H -3.261242 0.661671 -1.107421
H -2.794591 2.028488 -0.073652
H -0.434286 -1.637485 -0.074072
H -1.852535 -1.491153 -1.145732
H 1.934160 3.061739 -0.800727
H 1.258808 2.470984 0.729919
H -4.718685 0.792096 0.952149
H -3.283354 0.678551 1.997527
H -1.859558 -1.566355 1.954900
H -2.376460 -2.880357 0.874940
H -4.346956 -1.577868 1.812195
H -4.279484 -1.492312 0.034079
H 1.337662 0.246940 1.330519
H 2.400301 -1.422571 2.637125
H 3.483851 -2.539153 1.827266


