%chk=000250532.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000250532

0 1
O -0.605350 0.122909 -1.503826
O -0.408823 0.573740 0.765115
O -3.018859 -2.063622 -0.800938
O -2.735248 -1.688852 1.308113
N -2.797474 -1.333788 0.147086
C 1.564310 0.399199 -0.593725
C 2.509214 1.270098 0.270328
C 0.114537 0.904889 -0.530845
C -2.669053 0.178610 -0.148409
C 1.636045 -1.072642 -0.139617
C 3.960139 0.770136 0.099712
C -2.013640 0.371297 -1.538125
C -1.802648 0.856388 0.935731
C 4.086431 -0.726577 0.200792
C 2.429364 2.756968 -0.092164
C 3.036925 -1.549828 0.070363
C -4.106983 0.743998 -0.163728
C 5.475882 -1.233337 0.436163
C -4.799274 0.708716 1.192510
H 1.885220 0.457348 -1.664864
H 2.209883 1.142052 1.341188
H -0.031452 1.982208 -0.734463
H 1.112290 -1.706281 -0.885938
H 1.061471 -1.199271 0.807528
H 4.603464 1.259191 0.857612
H 4.359413 1.091076 -0.884939
H -2.366413 -0.384126 -2.275311
H -2.196952 1.390208 -1.922274
H -1.960349 1.949005 0.935779
H -1.998898 0.438872 1.948378
H 2.583033 2.927665 -1.163041
H 1.462563 3.190401 0.183862
H 3.195849 3.333058 0.440256
H 3.143174 -2.630846 0.133525
H -4.713107 0.181811 -0.908286
H -4.079293 1.788888 -0.537112
H 6.188992 -0.804581 -0.279601
H 5.545681 -2.325017 0.345032
H 5.822910 -0.972243 1.445357
H -4.740130 -0.281306 1.669361
H -4.370766 1.429159 1.898994
H -5.866078 0.949228 1.094223


%chk=000250532-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000250532

0 1
O -0.624703 -0.169159 -1.461495
O -0.402939 0.599657 0.806923
O -3.304399 -2.082692 -0.515739
O -2.632925 -1.529426 1.584199
N -2.864936 -1.245465 0.355611
C 1.591980 0.292199 -0.568615
C 2.475321 1.171427 0.364560
C 0.122146 0.714455 -0.556590
C -2.700653 0.235696 -0.119848
C 1.746563 -1.207782 -0.206304
C 3.962899 0.788255 0.158070
C -2.033452 0.225582 -1.519367
C -1.809978 1.008772 0.877637
C 4.220417 -0.713166 0.125311
C 2.282323 2.690435 0.156702
C 3.198950 -1.600259 -0.024202
C -4.138855 0.820871 -0.221459
C 5.665577 -1.149479 0.268531
C -4.940311 0.841345 1.098264
H 1.942990 0.440720 -1.611884
H 2.192628 0.923736 1.407224
H -0.029986 1.765114 -0.904248
H 1.283834 -1.825714 -0.998312
H 1.170621 -1.420389 0.717463
H 4.568240 1.244731 0.969288
H 4.336743 1.248200 -0.784285
H -2.528688 -0.499932 -2.180920
H -2.127847 1.251090 -1.941640
H -1.907605 2.091931 0.639705
H -2.112457 0.826171 1.917434
H 2.412947 2.970990 -0.907327
H 1.283643 3.028706 0.487037
H 3.030355 3.256465 0.743043
H 3.420459 -2.677452 -0.020298
H -4.688503 0.237844 -0.984764
H -4.042985 1.852983 -0.612073
H 6.302916 -0.681678 -0.509016
H 5.773666 -2.244920 0.182763
H 6.083747 -0.839057 1.247364
H -5.066711 -0.171473 1.519133
H -4.457612 1.470289 1.867086
H -5.947418 1.255181 0.914840


