%chk=000293406.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000293406

0 1
O -6.000828 -1.400738 -1.008952
O -4.560229 0.348544 1.517972
N 0.395628 0.001516 -0.643093
N -2.447402 -0.263792 -1.143892
C -0.597450 0.122097 0.477010
C -0.211856 0.488969 -1.923821
C -1.843533 -0.723118 0.151433
C -1.436762 -0.388073 -2.249999
C 1.649749 0.671156 -0.310193
C 2.697491 -0.136156 0.193671
C 2.469828 -1.608409 0.401451
C 3.928503 0.470531 0.507752
C -3.667810 -1.059646 -1.492869
C 3.764432 -2.409657 0.576985
C 5.098848 -0.325407 1.022369
C 4.703663 -1.705562 1.560892
C -4.777610 -0.929152 -0.426508
C 1.835126 2.050238 -0.493913
C 4.104362 1.850897 0.314337
C 3.064401 2.634145 -0.184352
C -4.970529 0.490629 0.133218
C -4.339114 1.605318 2.181851
H -0.895694 1.176631 0.665374
H -0.123328 -0.258154 1.407123
H 0.547316 0.388133 -2.728754
H -0.517640 1.557428 -1.883941
H -1.576509 -1.801062 0.143541
H -2.599730 -0.566541 0.959934
H -1.901406 -0.028332 -3.192119
H -1.109037 -1.437427 -2.418598
H 1.816771 -1.742586 1.289610
H 1.886568 -2.019757 -0.452327
H -4.051129 -0.671279 -2.463164
H -3.462516 -2.141510 -1.652955
H 3.530434 -3.430658 0.930109
H 4.266778 -2.530720 -0.402423
H 5.830633 -0.443754 0.193999
H 5.628747 0.242514 1.813632
H 5.607940 -2.316121 1.737460
H 4.206412 -1.597576 2.544392
H -4.629699 -1.649796 0.417700
H 1.024163 2.667426 -0.872994
H 5.058954 2.313710 0.554832
H 3.208888 3.703108 -0.329547
H -6.031292 0.794142 0.117160
H -4.343092 1.245003 -0.372820
H -6.285977 -0.837015 -1.752853
H -4.057840 1.294082 3.195464
H -5.258338 2.197438 2.202458
H -3.523085 2.154641 1.702263


%chk=000293406-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000293406

0 1
O -5.894193 -1.784857 -1.005289
O -4.358346 0.325934 1.505545
N 0.398500 0.318303 -0.665149
N -2.412149 -0.263102 -1.056063
C -0.501673 0.058473 0.488485
C -0.353910 0.936715 -1.776413
C -1.662564 -0.860142 0.080351
C -1.505610 0.007226 -2.199548
C 1.721030 0.802957 -0.388489
C 2.679224 -0.063767 0.242336
C 2.308895 -1.507779 0.570551
C 3.993735 0.420014 0.488399
C -3.588401 -1.058880 -1.463753
C 3.539348 -2.428803 0.709482
C 5.079373 -0.466817 1.102772
C 4.553207 -1.794978 1.685133
C -4.713418 -1.132238 -0.400997
C 2.109344 2.110304 -0.786356
C 4.349432 1.738866 0.103183
C 3.418543 2.574867 -0.541551
C -5.070696 0.231297 0.223079
C -4.480712 1.651076 2.106516
H -0.925467 1.017817 0.869192
H 0.066653 -0.404884 1.309087
H 0.327703 1.091229 -2.631504
H -0.787621 1.924994 -1.487848
H -1.255926 -1.868443 -0.188528
H -2.349160 -0.961757 0.937189
H -2.087548 0.494140 -3.005674
H -1.066456 -0.937228 -2.610855
H 1.748414 -1.552912 1.529148
H 1.609734 -1.875250 -0.205971
H -4.011596 -0.574219 -2.370802
H -3.321116 -2.106578 -1.752576
H 3.219887 -3.425951 1.067863
H 4.020048 -2.574081 -0.278963
H 5.828102 -0.693984 0.314989
H 5.622006 0.105964 1.880428
H 5.399000 -2.480659 1.882253
H 4.049504 -1.611488 2.655796
H -4.444295 -1.811279 0.424799
H 1.382363 2.772414 -1.267711
H 5.367587 2.097646 0.299972
H 3.702761 3.589928 -0.842184
H -6.167782 0.270616 0.400929
H -4.763040 1.069001 -0.440517
H -6.157072 -1.280068 -1.817915
H -3.923607 1.615254 3.056178
H -5.542023 1.907217 2.313875
H -4.043814 2.434191 1.451031


