%chk=000257652.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000257652

0 1
S -2.730434 -1.486275 0.769088
S 2.690609 -1.510047 0.845569
O -2.881158 -0.136884 -0.263489
O 2.882190 -0.162110 -0.182129
O -3.788965 -2.394225 0.416082
O -2.592613 -0.980280 2.101192
O 2.519716 -1.002751 2.173339
O 3.750686 -2.427255 0.522401
C -1.222659 -2.051145 0.157445
C 1.195793 -2.061749 0.191564
C -0.018926 -1.598240 0.706273
C -1.211356 -2.965306 -0.905794
C 1.206475 -2.975905 -0.871686
C 0.003005 -3.430328 -1.417659
C -4.018815 0.651013 -0.220004
C 4.025019 0.615801 -0.106459
C -6.206150 2.360579 -0.289763
C 6.228336 2.306145 -0.114249
C -5.304671 0.099942 -0.221292
C -3.795527 2.035580 -0.255723
C 5.305530 0.053491 -0.071590
C 3.814960 2.002265 -0.148228
C -6.396439 0.970017 -0.252609
C -4.900292 2.884036 -0.294313
C 6.405320 0.913969 -0.071972
C 4.927763 2.841013 -0.155520
C -7.376343 3.289039 -0.318617
C 7.406976 3.224302 -0.109968
H -0.027727 -0.887570 1.550934
H -2.158381 -3.323135 -1.333600
H 2.162018 -3.342071 -1.272655
H 0.011523 -4.143651 -2.243165
H -5.457468 -0.982645 -0.202553
H -2.778684 2.421306 -0.256976
H 5.448250 -1.030391 -0.048735
H 2.801975 2.396884 -0.178080
H -7.405015 0.557608 -0.249249
H -4.748933 3.962358 -0.323638
H 7.409752 0.492748 -0.040243
H 4.786731 3.920616 -0.188916
H -7.424876 3.892181 0.600000
H -8.335009 2.761547 -0.406485
H -7.315865 3.987422 -1.165190
H 7.376558 3.923038 -0.957863
H 7.434844 3.827162 0.809689
H 8.363074 2.688398 -0.170762


%chk=000257652-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000257652

0 1
S -2.889341 -1.595408 0.937945
S 2.752948 -1.481657 1.134232
O -2.992709 -0.144074 -0.511948
O 2.977799 -0.136339 -0.398786
O -4.011327 -2.748474 0.682497
O -2.728996 -0.899096 2.400367
O 2.433558 -0.712281 2.532525
O 3.921800 -2.613187 1.053194
C -1.214777 -2.260851 0.384473
C 1.150947 -2.216032 0.466178
C -0.059572 -1.662591 0.911105
C -1.204545 -3.328794 -0.527949
C 1.244843 -3.283547 -0.442124
C 0.046061 -3.846650 -0.937353
C -4.086890 0.691547 -0.445341
C 4.089780 0.675788 -0.329556
C -6.291510 2.492889 -0.433376
C 6.340136 2.419989 -0.320967
C -5.258227 0.391538 -1.200360
C -4.034388 1.879610 0.343326
C 5.310511 0.269582 -0.943489
C 4.007527 1.944881 0.317464
C -6.337800 1.292789 -1.197240
C -5.123818 2.766074 0.336334
C 6.413750 1.142207 -0.942828
C 5.119711 2.802315 0.308104
C -7.451370 3.468565 -0.441867
C 7.527453 3.362260 -0.329040
H -0.097540 -0.847196 1.641434
H -2.147666 -3.752655 -0.887282
H 2.225014 -3.673711 -0.733578
H 0.086053 -4.684041 -1.640246
H -5.288944 -0.538088 -1.777618
H -3.137082 2.076982 0.938395
H 5.361820 -0.718419 -1.412043
H 3.068853 2.227623 0.804516
H -7.233911 1.066870 -1.786619
H -5.081107 3.682072 0.937454
H 7.349146 0.833311 -1.423356
H 5.053599 3.781403 0.797288
H -7.700569 3.807081 0.580287
H -8.357026 3.022567 -0.886306
H -7.202046 4.373773 -1.029253
H 7.332234 4.240173 -0.974984
H 7.739162 3.750239 0.684281
H 8.439256 2.867460 -0.703487


