%chk=000189516.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000189516

0 1
S -3.074218 0.281757 -1.983777
F -2.954307 -2.231121 -0.862704
F -1.999874 -3.592919 0.443197
F -2.994893 -1.902384 1.235190
F 3.295892 -2.325563 -0.808005
F 2.504847 -3.442762 0.792783
O 2.825225 1.322132 -1.398137
O 3.662696 0.621505 0.585715
N 0.239318 -2.085577 0.307079
N -3.011782 1.351330 0.372624
C 0.187362 2.184283 -0.404401
C 0.369093 3.011659 0.901472
C 0.208428 0.702303 -0.205262
C -1.003064 -0.044943 -0.151980
C 1.417810 -0.005880 -0.071017
C -0.265053 2.343244 2.120274
C 1.841484 3.335756 1.173223
C -0.931446 -1.424018 0.122676
C 1.393789 -1.395909 0.202071
C -2.293287 0.580529 -0.413345
C 2.742704 0.660310 -0.198915
C -2.184685 -2.286011 0.237397
C 2.699012 -2.165052 0.402179
C -4.420693 1.263625 -1.505564
C -4.221122 1.740878 -0.240932
C 4.099549 1.962150 -1.695830
H 0.972797 2.480481 -1.138794
H -0.765164 2.503909 -0.879048
H -0.165723 3.981919 0.721551
H 0.227544 1.403092 2.388360
H -1.329858 2.121709 1.957208
H -0.208806 2.994245 3.000540
H 2.359161 3.693533 0.278342
H 1.930363 4.120662 1.934891
H 2.394941 2.471433 1.561255
H 3.405748 -1.657728 1.110261
H -5.264307 1.426707 -2.155988
H -4.889693 2.376066 0.334988
H 4.386396 2.629511 -0.876743
H 3.877386 2.508083 -2.619179
H 4.858830 1.188456 -1.852054


%chk=000189516-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000189516

0 1
S -3.197468 0.098569 -1.997765
F -2.569989 -2.970989 -0.770935
F -1.879157 -3.352656 1.352838
F -3.268052 -1.630982 0.926035
F 3.339176 -2.046461 -1.170607
F 2.415266 -3.627059 0.218764
O 2.895027 1.392633 -1.392997
O 3.716377 0.428236 0.556470
N 0.242389 -2.111607 0.287502
N -3.000366 1.463143 0.288271
C 0.134856 2.210837 -0.377742
C 0.344798 3.061513 0.940840
C 0.191226 0.704372 -0.207777
C -1.027382 -0.056837 -0.117988
C 1.418352 -0.019234 -0.124241
C -0.371674 2.471260 2.177929
C 1.832053 3.347276 1.258530
C -0.931796 -1.441854 0.186614
C 1.388617 -1.426919 0.101232
C -2.337797 0.567248 -0.424922
C 2.775363 0.620418 -0.251273
C -2.146318 -2.336788 0.428319
C 2.680008 -2.245564 0.109227
C -4.495411 1.227589 -1.521704
C -4.209296 1.832279 -0.308328
C 4.245575 1.968682 -1.636365
H 0.889438 2.527309 -1.117044
H -0.858267 2.472615 -0.778081
H -0.131662 4.036192 0.708087
H 0.108678 1.528758 2.504272
H -1.435168 2.264025 1.971154
H -0.308813 3.180890 3.023523
H 2.365114 3.763795 0.382928
H 1.902357 4.085868 2.078740
H 2.366517 2.441588 1.596383
H 3.401880 -1.955680 0.889329
H -5.367930 1.361526 -2.157420
H -4.849234 2.554957 0.197995
H 4.509738 2.665762 -0.823831
H 4.154546 2.488292 -2.599509
H 4.990829 1.158400 -1.684852


