%chk=000189409.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000189409

0 1
S -1.697100 -4.598842 0.340577
F 5.675732 1.885893 0.699143
F 3.796328 2.820546 0.478101
F 4.184342 1.602178 2.163919
F -5.222282 3.773178 -0.398631
N -0.391896 -0.287844 -0.296084
C 1.927300 -0.973723 -0.420150
C 0.495644 -1.324909 -0.252476
C -1.719375 -0.561782 -0.160888
C 2.459046 0.140763 0.246331
C 0.090518 -2.657297 -0.056144
C -2.646374 0.592052 -0.229218
C 3.816147 0.458029 0.094975
C -1.277853 -2.914405 0.093148
C -2.202161 -1.874173 0.040576
C 2.750194 -1.750148 -1.251949
C 4.639125 -0.320805 -0.729268
C 4.099105 -1.420913 -1.402359
C -3.842757 0.488332 -0.959697
C -2.321957 1.793101 0.426843
C 4.359239 1.651856 0.830913
C -4.727186 1.566362 -1.024344
C -3.194315 2.881977 0.378646
C -4.380504 2.739847 -0.347193
C -3.484190 -4.646256 0.557612
H 1.804254 0.755845 0.871789
H 0.828401 -3.457093 -0.006960
H -3.268564 -2.042094 0.163218
H 2.335164 -2.604638 -1.789070
H 5.696291 -0.081872 -0.858304
H 4.735957 -2.023430 -2.050597
H -4.080498 -0.434014 -1.491097
H -1.377238 1.874526 0.970890
H -5.654606 1.493798 -1.590219
H -2.949825 3.813987 0.887141
H -3.760630 -5.695971 0.741434
H -3.816959 -4.057970 1.421366
H -4.023921 -4.309490 -0.335070


%chk=000189409-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000189409

0 1
S -1.811386 -4.785025 -0.515042
F 5.481307 2.308333 -0.410514
F 3.635917 2.595502 -1.699570
F 3.508836 2.911217 0.536229
F -5.055512 3.938374 0.499997
N -0.351792 -0.394198 -0.055606
C 1.977564 -1.089951 -0.138710
C 0.524991 -1.441283 -0.174532
C -1.696461 -0.642854 -0.074756
C 2.363660 0.262895 -0.305835
C 0.079531 -2.775191 -0.336509
C -2.593528 0.542407 0.060086
C 3.727388 0.624709 -0.272935
C -1.312026 -3.039737 -0.335375
C -2.212901 -1.963030 -0.194524
C 2.991388 -2.064491 0.069760
C 4.732605 -0.347881 -0.070434
C 4.351499 -1.695892 0.102033
C -3.970236 0.492040 -0.291145
C -2.061241 1.766802 0.550742
C 4.087946 2.071056 -0.456757
C -4.800633 1.622687 -0.148869
C -2.874065 2.906876 0.703168
C -4.231712 2.806661 0.351429
C -3.685214 -4.689566 -0.448593
H 1.578024 1.008398 -0.457582
H 0.791117 -3.593575 -0.475120
H -3.290352 -2.132666 -0.152887
H 2.725117 -3.114147 0.230312
H 5.786118 -0.055524 -0.045064
H 5.118594 -2.458693 0.269120
H -4.405759 -0.421987 -0.707415
H -0.999477 1.800133 0.808563
H -5.858522 1.597730 -0.424925
H -2.474451 3.850389 1.085391
H -4.029212 -5.729864 -0.551374
H -4.019929 -4.286616 0.519613
H -4.074598 -4.089439 -1.285466


