%chk=000294302.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000294302

0 1
O 2.570384 0.920833 -1.194850
N 3.727156 0.416569 0.702259
C 5.794872 -0.758268 -0.139713
C 5.059558 0.615282 0.067563
C 7.116910 -0.492875 -0.885208
C 6.092047 -1.452317 1.200169
C 4.910339 -1.671596 -1.007475
C 5.857609 1.610932 0.916481
C -1.254605 0.205714 0.648025
C 0.044698 0.400644 -0.141049
C -2.477831 0.266792 -0.277073
C 1.274479 0.336261 0.773741
C -3.783605 0.074839 0.505747
C 2.544010 0.584398 -0.021818
C -5.005323 0.134456 -0.421206
C -6.311231 -0.056215 0.361260
C -7.533854 0.001366 -0.566388
C -8.813938 -0.187646 0.193240
C -9.818176 -0.952944 -0.229941
H 4.883120 1.065985 -0.951824
H 6.946731 0.023245 -1.836255
H 7.805844 0.116803 -0.292523
H 7.633558 -1.430667 -1.116577
H 5.175767 -1.706520 1.739874
H 6.706839 -0.825302 1.853514
H 6.639111 -2.388736 1.041656
H 4.584575 -1.163499 -1.924127
H 4.003389 -1.982813 -0.479791
H 5.442624 -2.579768 -1.305174
H 3.726738 0.113042 1.667064
H 5.303383 2.549362 1.044325
H 6.086525 1.223522 1.914583
H 6.810019 1.862048 0.435007
H -1.234452 -0.765045 1.179590
H -1.340497 0.980185 1.434465
H 0.134376 -0.364243 -0.938726
H 0.033854 1.372406 -0.677565
H -2.393022 -0.506888 -1.064869
H -2.497277 1.236824 -0.811229
H 1.316655 -0.647746 1.280499
H 1.187126 1.094258 1.578886
H -3.869102 0.850216 1.291309
H -3.763775 -0.894860 1.039604
H -5.024449 1.103319 -0.956826
H -4.919538 -0.641455 -1.206536
H -6.396093 0.718459 1.147594
H -6.295385 -1.027461 0.893493
H -7.431383 -0.756442 -1.369572
H -7.569304 0.980866 -1.089543
H -8.876543 0.366551 1.131959
H -10.742463 -1.070808 0.315600
H -9.798452 -1.519866 -1.148551


%chk=000294302-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000294302

0 1
O 2.819439 1.856008 -0.848806
N 3.757649 0.555590 0.843238
C 5.537755 -0.829402 -0.311037
C 5.136400 0.566654 0.304617
C 6.953451 -0.721189 -0.940229
C 5.533680 -1.951199 0.761454
C 4.525075 -1.191263 -1.430725
C 6.097937 1.099514 1.391784
C -1.176565 0.744292 0.718859
C 0.210640 0.671663 0.045087
C -2.319946 0.266602 -0.204666
C 1.356468 1.124410 0.982567
C -3.715006 0.352617 0.454362
C 2.696185 1.215700 0.242107
C -4.855922 -0.134740 -0.466908
C -6.250811 -0.045857 0.191403
C -7.390195 -0.539776 -0.740412
C -8.762697 -0.396100 -0.117462
C -9.646981 -1.405481 0.085248
H 5.104279 1.290935 -0.532334
H 7.010909 0.127825 -1.647861
H 7.741239 -0.587910 -0.176947
H 7.189363 -1.643448 -1.503230
H 4.529570 -2.082426 1.208891
H 6.255820 -1.752984 1.575267
H 5.812521 -2.916948 0.300253
H 4.493521 -0.405394 -2.207009
H 3.502891 -1.300070 -1.026711
H 4.808093 -2.146657 -1.911196
H 3.593424 0.072133 1.728315
H 5.765122 2.098067 1.725662
H 6.130747 0.437384 2.277836
H 7.126114 1.197826 1.004991
H -1.176004 0.132888 1.646142
H -1.374181 1.790062 1.035644
H 0.403398 -0.364986 -0.299281
H 0.231947 1.312703 -0.856240
H -2.125631 -0.781147 -0.516164
H -2.315010 0.872470 -1.134495
H 1.425358 0.451155 1.860297
H 1.120146 2.137132 1.366510
H -3.912491 1.402029 0.758236
H -3.717212 -0.246895 1.388829
H -4.853246 0.463598 -1.402207
H -4.659414 -1.184580 -0.769772
H -6.451294 1.004632 0.488686
H -6.262855 -0.642693 1.125347
H -7.212478 -1.596984 -1.018954
H -7.349546 0.049891 -1.681523
H -9.038858 0.624270 0.195781
H -10.625558 -1.231129 0.547112
H -9.415244 -2.437595 -0.207260


