%chk=000214831.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000214831

0 1
S -2.200674 -1.728742 0.755984
F -4.459415 3.464038 -0.506658
O -0.465942 -0.698237 -1.418648
O -2.601654 -2.721004 -0.201515
O -2.377426 -1.984321 2.174630
N 1.612089 -1.299710 -0.582810
N -0.462858 -1.542569 0.686790
C 3.185507 -0.029450 0.976885
C 4.111516 0.342667 -0.242601
C 2.993038 0.701577 -1.278246
C 2.147848 1.130259 0.996032
C 2.028192 1.605847 -0.469825
C 2.453584 -1.369093 0.647843
C 2.254750 -0.576999 -1.729172
C 3.919819 -0.181066 2.303251
C 5.037954 -0.788707 -0.698594
C 4.993394 1.569889 0.041590
C 0.209201 -1.121449 -0.482638
C -2.850238 -0.188623 0.369623
C -2.973376 0.212449 -0.967820
C -3.279013 0.652309 1.407700
C -3.523516 1.459176 -1.280545
C -3.829744 1.900863 1.123350
C -3.936596 2.272952 -0.223399
H 3.402950 1.223449 -2.162792
H 2.486819 1.949189 1.650796
H 1.177583 0.804677 1.400187
H 0.991951 1.528400 -0.841562
H 2.309382 2.666221 -0.569824
H 3.203362 -2.176922 0.474468
H 1.851182 -1.696564 1.520639
H 1.478285 -0.328354 -2.491639
H 2.954853 -1.294022 -2.211411
H 3.233831 -0.411182 3.126205
H 4.670911 -0.978237 2.262090
H 4.447520 0.740702 2.577930
H 4.504652 -1.723043 -0.909237
H 5.574631 -0.511963 -1.613264
H 5.791237 -1.013542 0.064842
H 4.421219 2.417803 0.430874
H 5.772334 1.339800 0.776289
H 5.496652 1.911134 -0.869645
H 0.096062 -1.890993 1.481199
H -2.626223 -0.448224 -1.778735
H -3.187259 0.324209 2.452001
H -3.618882 1.778791 -2.318028
H -4.167190 2.560112 1.921709


%chk=000214831-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000214831

0 1
S -2.214371 -1.891247 0.575274
F -5.842065 2.804319 -0.405726
O -0.550871 -0.458189 -1.521187
O -2.365390 -2.957359 -0.628090
O -2.431714 -2.353469 2.121201
N 1.480170 -0.399632 -0.348658
N -0.501022 -1.216193 0.682187
C 3.501982 0.259904 1.041127
C 4.387281 0.144375 -0.264635
C 3.425139 0.874747 -1.265273
C 3.037716 1.755299 1.015600
C 2.992098 2.159312 -0.495091
C 2.245544 -0.653881 0.894896
C 2.195759 0.005220 -1.591377
C 4.213050 -0.125399 2.352278
C 4.745452 -1.306007 -0.672106
C 5.719655 0.929966 -0.134955
C 0.127497 -0.683751 -0.468965
C -3.297917 -0.389561 0.244541
C -3.510446 0.015223 -1.083757
C -3.897246 0.209553 1.365199
C -4.381126 1.104700 -1.301509
C -4.764292 1.301361 1.142843
C -4.979027 1.718224 -0.184191
H 3.935558 1.108723 -2.218903
H 3.751553 2.383810 1.578792
H 2.052755 1.872480 1.502934
H 1.984223 2.487141 -0.804754
H 3.684365 2.993647 -0.705153
H 2.553631 -1.719583 0.960541
H 1.593043 -0.434987 1.761931
H 1.475997 0.563134 -2.213368
H 2.488995 -0.894836 -2.167848
H 3.536766 -0.002753 3.220051
H 4.555858 -1.177526 2.341948
H 5.092786 0.516981 2.529686
H 3.867488 -1.959511 -0.807891
H 5.305329 -1.307182 -1.626574
H 5.396198 -1.775043 0.089935
H 5.575479 1.962874 0.225371
H 6.415687 0.424062 0.558705
H 6.218620 0.985471 -1.121029
H -0.010268 -1.642366 1.476384
H -2.997810 -0.488659 -1.906396
H -3.706109 -0.179089 2.370165
H -4.588373 1.475968 -2.308444
H -5.265328 1.813226 1.968588


