%chk=000245053.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000245053

0 1
O -5.919479 -0.504902 0.401091
N 1.289744 0.873101 0.147771
C 2.646813 0.614508 -0.419429
C 0.202663 0.074871 -0.495957
C -1.125686 0.350989 0.226232
C 3.275476 -0.738211 -0.001231
C 3.553878 1.801283 -0.007656
C -2.291825 -0.357868 -0.473473
C -3.611508 -0.102697 0.260247
C 2.792859 -1.908646 -0.852082
C 3.900212 1.859204 1.477153
C -4.782498 -0.788691 -0.443904
H 2.556877 0.635932 -1.538121
H 0.132418 0.397522 -1.558439
H 0.415375 -1.021620 -0.507970
H 1.294067 0.712178 1.159451
H -1.063231 0.028036 1.282947
H -1.307138 1.445292 0.258992
H 4.378815 -0.666346 -0.075843
H 3.067766 -0.938317 1.066912
H 3.042018 2.743739 -0.298069
H 4.483450 1.761019 -0.607045
H -2.093917 -1.446112 -0.528309
H -2.367856 -0.007223 -1.521654
H -3.816783 0.984262 0.338994
H -3.557955 -0.459898 1.308964
H 1.700156 -2.030383 -0.785164
H 3.044672 -1.772695 -1.909778
H 3.249235 -2.849714 -0.525265
H 3.000573 1.961013 2.095436
H 4.436190 0.965398 1.812106
H 4.538557 2.723898 1.694301
H -4.970196 -0.374903 -1.449506
H -4.655022 -1.883575 -0.505295
H -6.733722 -0.853345 -0.003509


%chk=000245053-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000245053

0 1
O -6.057483 -0.401110 0.491879
N 1.409336 -0.167277 0.230227
C 2.693976 0.112152 -0.464125
C 0.178365 0.172905 -0.514433
C -1.077994 -0.214096 0.290258
C 3.830870 -0.712924 0.191111
C 3.004545 1.636577 -0.459703
C -2.392391 0.089654 -0.462833
C -3.647608 -0.286591 0.356158
C 3.753028 -2.230017 -0.095632
C 3.179914 2.242585 0.949007
C -4.950336 0.008118 -0.391539
H 2.633908 -0.202210 -1.541085
H 0.164353 1.264848 -0.699402
H 0.138932 -0.318914 -1.522016
H 1.370449 -1.139430 0.566329
H -1.040209 -1.298083 0.532432
H -1.059984 0.325236 1.257069
H 4.799118 -0.326044 -0.182440
H 3.815657 -0.535928 1.283949
H 2.186621 2.169395 -0.984458
H 3.918345 1.803215 -1.065790
H -2.398223 -0.460221 -1.427495
H -2.424359 1.169921 -0.717962
H -3.656536 0.269764 1.313284
H -3.625182 -1.364105 0.610918
H 2.829424 -2.686815 0.309155
H 3.773292 -2.427550 -1.184093
H 4.605614 -2.764347 0.362166
H 2.308282 1.986683 1.576845
H 4.086358 1.855399 1.449290
H 3.269996 3.343445 0.899079
H -5.015775 1.092969 -0.629596
H -4.977684 -0.560919 -1.347241
H -6.921620 -0.219186 0.043584


