%chk=000184589.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000184589

0 1
S 0.853066 -4.390696 -0.440247
O 2.912011 2.816959 1.241415
O 4.537691 1.422587 0.510144
N -2.157056 -1.933652 -0.343426
N -0.794986 -3.879831 -0.275705
N -2.278166 -0.824085 0.545993
C 0.419803 -1.836171 -0.374461
C 2.015296 -0.037852 -0.495146
C 1.487825 -2.760387 -0.470035
C 0.687358 -0.463109 -0.386085
C -0.866014 -2.556459 -0.282251
C 2.317052 1.434392 -0.546140
C 3.069083 -0.974735 -0.585893
C 2.812882 -2.343599 -0.573296
C -2.814790 0.360020 -0.083474
C 3.403255 1.826809 0.420662
C -3.416908 1.320336 0.755040
C -2.644310 0.620259 -1.454941
C -3.827284 2.538994 0.212844
C -3.069420 1.842556 -1.976926
C -3.658196 2.804873 -1.149843
C 3.816210 3.342273 2.250380
H -0.131910 0.254795 -0.307571
H 2.641948 1.714472 -1.576419
H 1.399971 2.040920 -0.352763
H 4.100956 -0.612305 -0.651043
H 3.627241 -3.063163 -0.640485
H -2.923865 -2.628430 -0.243222
H -2.765196 -1.068006 1.424963
H -3.552029 1.128064 1.816262
H -2.189076 -0.129289 -2.103582
H -4.286635 3.286902 0.859016
H -2.940958 2.046137 -3.040090
H -3.985401 3.754958 -1.565022
H 3.233640 4.157165 2.692556
H 4.734559 3.703103 1.776575
H 4.038649 2.556195 2.978716


%chk=000184589-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000184589

0 1
S 0.873006 -4.498767 -0.462481
O 2.747095 2.751124 1.340187
O 4.572951 1.560257 0.522874
N -2.090072 -1.928556 -0.202333
N -0.834280 -3.903443 -0.250201
N -2.265734 -0.749441 0.529390
C 0.457011 -1.864762 -0.371351
C 2.080890 -0.044650 -0.570942
C 1.522275 -2.807482 -0.481624
C 0.748469 -0.476036 -0.424436
C -0.831279 -2.555869 -0.253359
C 2.394920 1.449410 -0.653737
C 3.131987 -1.007073 -0.659286
C 2.862501 -2.387917 -0.621084
C -2.777882 0.418928 -0.076108
C 3.369796 1.896702 0.430270
C -3.156107 1.512893 0.751736
C -2.898996 0.533102 -1.487247
C -3.643134 2.701202 0.170289
C -3.393987 1.728279 -2.051702
C -3.768549 2.820442 -1.234616
C 3.603428 3.239068 2.451568
H -0.062999 0.252991 -0.352894
H 2.873468 1.675149 -1.626027
H 1.471726 2.044150 -0.577730
H 4.165915 -0.656768 -0.749742
H 3.677959 -3.113369 -0.700598
H -2.886630 -2.578415 -0.240139
H -2.277114 -0.820815 1.551493
H -3.066857 1.430835 1.842659
H -2.608116 -0.311543 -2.118855
H -3.930032 3.536532 0.819310
H -3.485565 1.804694 -3.141335
H -4.152074 3.743579 -1.681035
H 2.950697 3.900731 3.037387
H 4.472611 3.786750 2.050640
H 3.959001 2.389088 3.057560


