%chk=000287721.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000287721

0 1
S 0.000539 -0.745556 -1.326898
N 0.000444 -1.023808 1.274996
C -0.000726 1.387807 0.552865
C 1.268885 1.820989 1.322741
C -1.270857 1.819677 1.322619
C 0.000052 -0.096078 0.359268
C 2.507284 1.657980 0.484148
C -2.509005 1.655383 0.483906
C 0.001317 -2.375676 -0.705329
C 0.001166 -2.332780 0.716227
C 3.262973 0.478337 0.562858
C -2.915757 2.682712 -0.381050
C 2.913071 2.685742 -0.380746
C -3.263495 0.474970 0.562566
C 0.001999 -3.583245 -1.395356
C 0.001709 -3.524854 1.456715
C 4.414120 0.331626 -0.215128
C -4.068272 2.529438 -1.156506
C 4.065819 2.533663 -1.156090
C -4.414414 0.327066 -0.215532
C 4.818721 1.358106 -1.074832
C -4.819980 1.353113 -1.075297
C 0.002535 -4.762450 -0.647921
C 0.002391 -4.731142 0.759645
H -0.000944 1.900910 -0.446158
H 1.163597 2.876387 1.646923
H 1.353783 1.235920 2.264484
H -1.355240 1.234521 2.264354
H -1.166694 2.875184 1.646809
H 2.948003 -0.326943 1.226280
H -2.335727 3.599980 -0.450433
H 2.332110 3.602418 -0.450167
H -2.947766 -0.329974 1.226034
H 0.002112 -3.609917 -2.483534
H 0.001593 -3.491074 2.545086
H 4.995980 -0.586632 -0.152617
H -4.380698 3.328819 -1.826112
H 4.377494 3.333378 -1.825648
H -4.995341 -0.591785 -0.153059
H 5.715276 1.241479 -1.679384
H -5.716355 1.235557 -1.679936
H 0.003075 -5.724385 -1.159008
H 0.002823 -5.671161 1.311418


%chk=000287721-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000287721

0 1
S 0.000371 -0.622326 -1.528734
N 0.000475 -0.924599 1.142507
C -0.000818 1.494454 0.485422
C 1.283193 1.908568 1.283694
C -1.285328 1.907234 1.283578
C -0.000027 0.010050 0.214623
C 2.576988 1.667413 0.521652
C -2.578796 1.664767 0.521399
C 0.001288 -2.290832 -0.832637
C 0.001208 -2.226464 0.601516
C 3.298562 0.455852 0.678159
C -3.078474 2.636754 -0.383826
C 3.075922 2.640019 -0.383319
C -3.299311 0.452594 0.678044
C 0.001994 -3.524987 -1.512412
C 0.001856 -3.423462 1.356822
C 4.485056 0.220741 -0.052010
C -4.263981 2.404477 -1.116983
C 4.261738 2.408938 -1.116355
C -4.485498 0.216290 -0.052237
C 4.970669 1.196068 -0.953379
C -4.971854 1.191010 -0.953863
C 0.002631 -4.709226 -0.741818
C 0.002562 -4.658161 0.679195
H -0.001056 2.032530 -0.481975
H 1.181824 2.983495 1.530174
H 1.280627 1.344622 2.234566
H -1.282290 1.343288 2.234448
H -1.185082 2.982263 1.530071
H 2.925308 -0.303645 1.375182
H -2.539461 3.584989 -0.509108
H 2.536081 3.587797 -0.508491
H -2.925471 -0.306443 1.375255
H 0.002051 -3.573058 -2.605548
H 0.001796 -3.365575 2.449396
H 5.029570 -0.720915 0.081945
H -4.637657 3.168130 -1.808814
H 4.634828 3.173058 -1.807987
H -5.029198 -0.725821 0.081827
H 5.891615 1.015493 -1.519176
H -5.892566 1.009505 -1.519744
H 0.003187 -5.679609 -1.249960
H 0.003068 -5.591572 1.252103


