%chk=000289331.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000289331

0 1
O 3.118061 -2.556819 -0.572860
O 0.758547 0.176200 1.019955
O 3.708489 -1.833502 1.803544
O -1.220950 2.937711 -1.027403
O -0.375877 0.951310 -0.960202
N -0.538073 2.070918 -0.500025
C -1.641760 -2.460234 -0.583785
C -2.634862 -1.423113 -1.125769
C -0.255043 -2.268787 -1.212977
C -3.998441 -1.529346 -0.431633
C 0.754537 -3.289048 -0.675383
C -4.985192 -0.489649 -0.979698
C 2.109799 -3.212474 -1.375715
C -6.348734 -0.582621 -0.280753
C 3.001182 -1.127131 -0.429817
C 2.965418 -0.852414 1.086995
C -7.333014 0.451186 -0.823985
C 1.532889 -0.883100 1.653146
C 0.827206 1.439246 1.516202
C 0.131728 2.410978 0.753496
C 1.497633 1.812807 2.699860
C 0.091460 3.746297 1.213722
C 1.449381 3.134415 3.121316
C 0.743805 4.104396 2.382996
H -1.572057 -2.371386 0.517062
H -2.015881 -3.481738 -0.785071
H -2.216987 -0.401873 -0.993276
H -2.754923 -1.549821 -2.218542
H 0.100947 -1.231925 -1.010899
H -0.331186 -2.347870 -2.314264
H -4.411639 -2.547328 -0.564848
H -3.876658 -1.392257 0.659886
H 0.898918 -3.133751 0.418613
H 0.343357 -4.312820 -0.776231
H -4.567561 0.528627 -0.856105
H -5.111812 -0.627339 -2.070664
H 2.059227 -2.719551 -2.361324
H 2.575164 -4.211924 -1.490389
H -6.767774 -1.599859 -0.407120
H -6.222396 -0.440439 0.810212
H 2.112512 -0.718659 -0.945199
H 3.923745 -0.728703 -0.890333
H 3.470258 0.109889 1.334749
H -6.961388 1.472915 -0.684336
H -7.510726 0.313475 -1.896627
H -8.301883 0.381137 -0.318025
H 0.968657 -1.787386 1.321569
H 1.509812 -0.813477 2.750808
H 3.666723 -2.709527 1.322191
H 2.041532 1.069106 3.280950
H -0.463391 4.486738 0.623219
H 1.964301 3.429484 4.039350
H 0.713817 5.134738 2.734417


%chk=000289331-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000289331

0 1
O 2.468710 -2.611639 0.090139
O 1.366042 0.383990 1.937959
O 4.611313 -1.331606 1.133470
O -2.021256 2.515514 1.422338
O -0.797925 0.898285 0.382735
N -0.896667 1.935986 1.145311
C -2.073485 -2.770270 -0.848135
C -2.964485 -1.559551 -1.207501
C -0.563596 -2.469196 -0.990990
C -4.471540 -1.824696 -0.993298
C 0.323268 -3.692811 -0.668672
C -5.359248 -0.616041 -1.367055
C 1.831864 -3.503800 -0.904014
C -6.866555 -0.865252 -1.132005
C 2.617491 -1.202280 -0.312319
C 3.402094 -0.555753 0.839586
C -7.744894 0.346092 -1.514104
C 2.555591 -0.479443 2.131483
C 1.485562 1.760916 2.012714
C 0.332523 2.544140 1.692229
C 2.649208 2.445290 2.456611
C 0.326696 3.946099 1.868461
C 2.646134 3.846997 2.599959
C 1.484833 4.605599 2.317449
H -2.283358 -3.080750 0.197130
H -2.343839 -3.635355 -1.490947
H -2.651778 -0.685473 -0.602444
H -2.789483 -1.281470 -2.268610
H -0.313455 -1.624857 -0.321249
H -0.356412 -2.127492 -2.027886
H -4.783596 -2.708392 -1.589931
H -4.647441 -2.089842 0.070629
H 0.170255 -4.001653 0.384515
H -0.001253 -4.550321 -1.297424
H -5.037246 0.268132 -0.778892
H -5.194081 -0.355767 -2.433949
H 2.029065 -3.119394 -1.927827
H 2.356787 -4.469759 -0.786415
H -7.185192 -1.753870 -1.715182
H -7.030462 -1.119371 -0.064628
H 1.638353 -0.704995 -0.441889
H 3.201676 -1.138511 -1.253831
H 3.744389 0.451317 0.541827
H -7.462106 1.239245 -0.925490
H -7.624796 0.599907 -2.584509
H -8.817158 0.145695 -1.332026
H 2.127459 -1.468947 2.355089
H 3.172253 -0.141858 2.983215
H 4.352999 -2.285560 0.999538
H 3.555373 1.885366 2.702170
H -0.592189 4.492242 1.637641
H 3.558008 4.348340 2.941674
H 1.486445 5.692527 2.438348


