%chk=000228170.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000228170

0 1
S 1.048331 -1.487940 1.309614
F -5.652237 -0.611885 -1.387779
F -5.369189 -1.341249 0.745027
F -5.892945 0.827523 0.338805
O 1.053894 -2.636173 2.465145
O 1.056860 -1.915663 -0.267700
O 6.040994 0.113777 -0.788179
O 4.745081 0.168840 -2.717946
N -0.486163 -0.338601 1.767265
N 2.363839 0.649809 -1.141429
C 2.529792 -0.254034 1.656398
C 3.668470 -0.484340 0.657994
C 3.672883 0.558519 -0.495647
C -1.381491 0.010332 0.721854
C 4.827327 0.251248 -1.476849
C -2.749309 -0.374736 0.776373
C -3.641785 0.081667 -0.213556
C -0.915925 0.809239 -0.358899
C -3.184313 0.877212 -1.292491
C -1.817418 1.224896 -1.358368
C -5.101403 -0.261935 -0.129575
H 2.048520 0.730334 1.574892
H 2.766455 -0.513484 2.699723
H 3.604737 -1.504165 0.230057
H 4.634284 -0.417327 1.185189
H 3.921734 1.545754 -0.051521
H -0.926517 -0.903952 2.519110
H -3.111750 -1.012389 1.590400
H 1.934205 -0.269556 -1.327137
H 2.367702 1.242687 -1.978867
H 0.145928 1.084211 -0.406912
H -3.882260 1.207752 -2.067503
H -1.456783 1.836172 -2.192053
H 6.780953 -0.049740 -1.433438


%chk=000228170-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000228170

0 1
S 1.038130 -1.483073 1.287355
F -5.767314 -0.419912 -1.324785
F -5.362238 -1.413326 0.679063
F -5.855929 0.794629 0.582780
O 1.034611 -2.636165 2.438342
O 1.045540 -1.908547 -0.290556
O 6.081966 0.146256 -0.737877
O 4.816456 0.246452 -2.686141
N -0.486279 -0.299139 1.736494
N 2.397741 0.607319 -1.160917
C 2.531341 -0.270439 1.649630
C 3.676404 -0.505996 0.661992
C 3.693560 0.544787 -0.481020
C -1.391504 0.021503 0.689265
C 4.876629 0.284154 -1.440751
C -2.759416 -0.354202 0.774275
C -3.665560 0.083921 -0.213354
C -0.938886 0.793775 -0.417417
C -3.222030 0.851443 -1.316191
C -1.853222 1.189062 -1.412373
C -5.126059 -0.239577 -0.075873
H 2.063609 0.721447 1.573216
H 2.763023 -0.539797 2.691953
H 3.617442 -1.522753 0.227203
H 4.635302 -0.454173 1.205011
H 3.908352 1.534546 -0.023317
H -0.927288 -0.848711 2.501099
H -3.111664 -0.976649 1.604551
H 1.990633 -0.322741 -1.343786
H 2.413674 1.192286 -2.004080
H 0.123214 1.062506 -0.489043
H -3.931107 1.165908 -2.087512
H -1.501675 1.775278 -2.267421
H 6.835045 0.022731 -1.377816


