%chk=000189430.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000189430

0 1
S 2.219455 -4.265982 -0.760577
F -5.712759 1.546033 -0.563949
F -3.940557 2.633775 -0.201791
F -4.186679 1.579185 -2.019374
N 0.534345 -0.145049 0.183922
C 2.718659 0.925388 0.160250
C 1.875671 -0.287228 0.015040
C -0.255701 -1.255911 0.075179
C -1.710204 -1.050410 0.283136
C 2.679015 1.965320 -0.790822
C 2.475757 -1.534216 -0.274331
C 0.265591 -2.527154 -0.221299
C 1.650797 -2.647766 -0.394393
C -2.345621 0.073972 -0.266339
C -3.723504 0.253199 -0.081401
C 3.568287 1.017693 1.272947
C -2.452766 -1.974010 1.036408
C 3.510633 3.083126 -0.609621
C 1.771024 1.888630 -1.972549
C -4.465705 -0.672647 0.663917
C -3.823534 -1.781450 1.223025
C 4.385945 2.136069 1.442223
C 4.355751 3.167868 0.497822
C -4.377839 1.461310 -0.692669
C 4.006763 -4.139330 -0.944671
H 3.553928 -1.588604 -0.399338
H -0.396099 -3.385901 -0.324216
H -1.753478 0.805106 -0.826099
H 3.581559 0.215716 2.010760
H -1.958692 -2.837303 1.485312
H 3.490188 3.893356 -1.336404
H 1.909264 2.719495 -2.675067
H 1.912244 0.956007 -2.536491
H 0.716197 1.909130 -1.648297
H -5.537979 -0.541614 0.819197
H -4.397258 -2.498593 1.810528
H 5.040508 2.206739 2.308063
H 4.991997 4.042412 0.628493
H 4.381067 -5.146450 -1.183082
H 4.499652 -3.807551 -0.023146
H 4.296276 -3.471361 -1.764797


%chk=000189430-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000189430

0 1
S 2.392974 -4.482335 0.156921
F -5.396072 2.031665 -0.062564
F -4.328948 1.994243 1.933693
F -3.266558 2.804131 0.105994
N 0.529326 -0.222466 -0.108715
C 2.716166 0.893997 -0.175388
C 1.889562 -0.351434 -0.118558
C -0.243816 -1.353987 -0.020500
C -1.722766 -1.138036 -0.016121
C 2.402163 1.989346 -1.043012
C 2.527865 -1.623083 -0.052949
C 0.323527 -2.646995 0.077551
C 1.733385 -2.784589 0.052379
C -2.228272 0.164619 0.226261
C -3.618260 0.399017 0.230191
C 3.855378 0.978400 0.671975
C -2.645320 -2.190604 -0.258796
C 3.253126 3.124356 -1.020067
C 1.221415 1.977176 -1.997932
C -4.534615 -0.653671 -0.005567
C -4.035224 -1.948829 -0.253868
C 4.681817 2.120053 0.685330
C 4.377199 3.202619 -0.169035
C -4.136738 1.775033 0.536765
C 4.249561 -4.208482 0.099981
H 3.617625 -1.673626 -0.108828
H -0.309445 -3.532002 0.187902
H -1.510750 0.972112 0.397120
H 4.071667 0.149760 1.356443
H -2.286287 -3.201243 -0.478586
H 3.024651 3.962747 -1.688932
H 1.319080 2.783676 -2.745536
H 1.131812 1.014339 -2.531132
H 0.270874 2.114789 -1.454485
H -5.611103 -0.458446 -0.009570
H -4.731541 -2.769792 -0.452415
H 5.544552 2.167475 1.358604
H 5.007330 4.099081 -0.174000
H 4.690718 -5.214248 0.172624
H 4.579521 -3.599187 0.955444
H 4.546616 -3.744581 -0.853122


