%chk=000207031.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000207031

0 1
S 1.697612 -2.384734 -0.163256
S 3.948057 -0.696717 -1.106061
N -2.135171 0.123078 -0.166011
N 1.617104 0.275267 -0.248265
C -0.798005 -0.049001 -0.813030
C 0.241676 0.163167 0.312493
C -3.038713 -1.050479 -0.399622
C -2.779126 1.416474 -0.572995
C 2.108968 1.669151 -0.491200
C -2.540178 -2.263712 0.385180
C -3.849797 1.809165 0.445878
C 2.820239 2.221004 0.738773
C 2.405105 -0.782525 -0.501179
H -0.617893 0.660956 -1.646782
H -0.676874 -1.062224 -1.255450
H 0.172174 -0.657569 1.063852
H 0.002008 1.089902 0.884755
H -4.055864 -0.775092 -0.037351
H -3.143161 -1.305091 -1.476523
H -1.994761 2.205674 -0.594936
H -3.219044 1.375035 -1.593142
H 2.799012 1.676013 -1.372226
H 1.237987 2.304812 -0.765191
H -1.595760 -2.655105 -0.010757
H -2.363455 -2.005764 1.438073
H -3.273649 -3.076320 0.358398
H -4.712298 1.133066 0.417716
H -3.451172 1.772065 1.469087
H -4.213911 2.825136 0.262187
H 2.178277 2.232436 1.626199
H 3.710598 1.621808 0.987495
H 3.166439 3.246530 0.561593
H 2.773979 -3.137506 -0.511802


%chk=000207031-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000207031

0 1
S 1.676839 -2.375434 0.342116
S 4.072091 -0.803330 -0.865988
N -2.155601 0.043708 -0.191628
N 1.651815 0.293993 -0.183986
C -0.788727 -0.065370 -0.747920
C 0.264301 0.252388 0.347194
C -3.071868 -1.044362 -0.626565
C -2.730049 1.408550 -0.326440
C 2.136119 1.625092 -0.647531
C -2.759393 -2.391235 0.052948
C -3.785897 1.733454 0.747522
C 2.859840 2.401771 0.470410
C 2.470209 -0.798061 -0.269764
H -0.633565 0.615106 -1.619358
H -0.615066 -1.091705 -1.114291
H 0.183804 -0.492977 1.156699
H 0.047513 1.238072 0.797158
H -4.100809 -0.743999 -0.357832
H -3.058629 -1.168253 -1.738703
H -1.898449 2.133053 -0.229046
H -3.165294 1.568393 -1.345704
H 2.821458 1.457530 -1.496181
H 1.254594 2.185288 -1.011019
H -1.736984 -2.742493 -0.177429
H -2.844362 -2.291923 1.149109
H -3.466562 -3.169665 -0.289587
H -4.659511 1.060086 0.684558
H -3.348710 1.627770 1.755666
H -4.154331 2.769167 0.625512
H 2.202034 2.561808 1.344108
H 3.754872 1.846250 0.797039
H 3.181479 3.390440 0.095640
H 2.817238 -3.114215 0.099195


