%chk=000256056.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000256056

0 1
O 1.884643 1.296573 0.693752
O 4.424646 -0.100716 0.500647
N -2.626755 0.485934 -1.197999
N -1.469461 -0.204829 -1.074458
C -4.561564 -0.376498 1.042624
C -3.298970 0.198731 1.697764
C -4.237444 -1.237284 -0.183815
C -2.866884 1.562005 1.146501
C -3.799156 -0.423387 -1.409340
C -2.922042 1.705254 -0.383931
C -0.388738 0.304721 -0.540273
C 0.870766 -0.452249 -0.608977
C 2.021150 0.091865 0.004254
C 0.984977 -1.695204 -1.255060
C 3.241906 -0.612676 -0.018810
C 2.205041 -2.373871 -1.296759
C 3.338897 -1.846232 -0.675117
C 2.606178 2.396009 0.069638
C 4.383289 0.182275 1.926181
H -5.104510 -0.997383 1.782660
H -5.258626 0.437214 0.768426
H -3.460756 0.294133 2.789688
H -2.462052 -0.522389 1.586985
H -3.441936 -1.967542 0.073048
H -5.122751 -1.843614 -0.457769
H -3.499540 2.357202 1.589061
H -1.836579 1.770492 1.502041
H -3.535616 -1.119948 -2.240312
H -4.635136 0.211666 -1.775508
H -3.930506 2.063510 -0.688030
H -2.206808 2.496153 -0.707099
H -0.306864 1.269696 -0.017854
H 0.103097 -2.124521 -1.735503
H 2.272490 -3.330277 -1.814486
H 4.293188 -2.368258 -0.692448
H 2.161894 2.615641 -0.904746
H 3.669442 2.146986 -0.026480
H 2.445204 3.213594 0.778639
H 4.326254 -0.761392 2.475229
H 3.537120 0.835319 2.170295
H 5.342812 0.682996 2.090542


%chk=000256056-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000256056

0 1
O 1.975495 1.385738 0.616617
O 4.512630 0.010625 0.484980
N -2.644669 0.372692 -1.033118
N -1.447949 -0.287074 -1.047986
C -4.747542 -0.363540 1.043905
C -3.486925 0.205711 1.756384
C -4.421046 -1.230845 -0.199595
C -2.961155 1.562557 1.221083
C -3.814977 -0.450283 -1.392388
C -2.883008 1.653329 -0.335643
C -0.355661 0.255439 -0.521662
C 0.924767 -0.455183 -0.611023
C 2.093834 0.128687 -0.037165
C 1.053528 -1.719652 -1.259149
C 3.340371 -0.554750 -0.081369
C 2.298303 -2.370316 -1.336040
C 3.448559 -1.795201 -0.742276
C 2.730299 2.482110 -0.035337
C 4.482320 0.130560 1.960110
H -5.304071 -0.996861 1.762322
H -5.436777 0.461973 0.765873
H -3.699141 0.330758 2.836401
H -2.677494 -0.547906 1.686372
H -3.709369 -2.025366 0.100423
H -5.340586 -1.738571 -0.556623
H -3.622590 2.381586 1.567393
H -1.967047 1.752090 1.668531
H -3.491648 -1.154724 -2.177815
H -4.580672 0.222485 -1.825884
H -3.839824 2.037570 -0.731602
H -2.099339 2.378152 -0.634928
H -0.338974 1.224647 -0.002425
H 0.155212 -2.158592 -1.703283
H 2.379938 -3.334546 -1.849934
H 4.425239 -2.288005 -0.774369
H 2.342643 2.657611 -1.056963
H 3.807226 2.240351 -0.079539
H 2.558639 3.371518 0.591013
H 4.404957 -0.872322 2.422207
H 3.636021 0.760777 2.288553
H 5.440784 0.596471 2.237150


