%chk=000238369.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000238369

0 1
O 1.000503 -2.809473 -0.586946
N 2.183381 0.137388 -0.435765
N -2.237650 -0.000265 0.393025
C -0.016965 -1.981883 0.018833
C 0.730550 -1.160290 1.116438
C -0.611273 -1.095957 -1.121571
C -1.047897 -2.907985 0.672262
C 1.806488 -2.017177 1.795276
C -1.530144 -1.879461 -2.065633
C 1.384090 0.134422 0.664791
C -1.356354 0.130220 -0.636510
C 1.185995 1.304439 1.436227
C -1.147967 1.372251 -1.279398
C 1.828975 2.483060 1.062915
C -1.863401 2.488018 -0.849160
C 2.804360 1.295051 -0.785183
C -2.927419 1.098726 0.800561
C 2.657291 2.488984 -0.065191
C -2.772532 2.359121 0.207682
H -0.051732 -0.892881 1.879395
H 0.284413 -0.759685 -1.721216
H -1.455478 -3.635229 -0.035003
H -1.897373 -2.336909 1.075208
H -0.601319 -3.478551 1.494384
H 2.335681 -1.463340 2.575346
H 2.547467 -2.353224 1.049260
H 1.376005 -2.919565 2.241386
H -1.039874 -2.781951 -2.445475
H -1.811792 -1.270415 -2.933249
H -2.460512 -2.181510 -1.566219
H 0.622443 -3.376540 -1.282321
H 0.538056 1.281723 2.308833
H -0.431575 1.452492 -2.094009
H 1.689119 3.393267 1.645155
H -1.716237 3.454483 -1.330841
H 3.440419 1.240223 -1.676114
H -3.624189 0.940694 1.631523
H 3.174399 3.391719 -0.374460
H -3.343651 3.212611 0.560065


%chk=000238369-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000238369

0 1
O 1.008882 -2.868342 -0.647787
N 2.187119 0.156473 -0.480617
N -2.351728 -0.019623 0.337798
C -0.004507 -1.998043 0.007268
C 0.767930 -1.165052 1.096314
C -0.636083 -1.094764 -1.119188
C -1.049743 -2.896508 0.708787
C 1.859848 -2.019286 1.801437
C -1.558280 -1.891781 -2.083937
C 1.415503 0.147055 0.653176
C -1.396297 0.138048 -0.636048
C 1.285378 1.304802 1.467735
C -1.160941 1.402569 -1.239475
C 1.963141 2.490529 1.115325
C -1.923885 2.520690 -0.844176
C 2.830321 1.312068 -0.816241
C -3.075632 1.071586 0.720383
C 2.757060 2.500527 -0.054894
C -2.906446 2.357274 0.159803
H -0.000247 -0.894859 1.847109
H 0.238457 -0.742749 -1.697093
H -1.490016 -3.619891 -0.003265
H -1.869011 -2.278698 1.112836
H -0.576659 -3.474130 1.522023
H 2.282576 -1.465142 2.659914
H 2.665315 -2.251213 1.087630
H 1.447457 -2.973397 2.172791
H -1.048049 -2.788141 -2.486327
H -1.836805 -1.262700 -2.948996
H -2.489460 -2.207081 -1.582300
H 0.523818 -3.545735 -1.184006
H 0.654549 1.267569 2.362795
H -0.380117 1.496449 -2.001509
H 1.871574 3.388509 1.736271
H -1.752378 3.500328 -1.303537
H 3.432846 1.270251 -1.732228
H -3.822162 0.897105 1.504955
H 3.303193 3.396046 -0.368783
H -3.522221 3.195857 0.500361


