%chk=000243942.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000243942

0 1
S -5.011223 1.790945 -0.547588
S 5.017486 -1.796557 0.546603
O -0.258241 0.612449 -1.232257
O 0.264603 -0.617062 1.236746
O -3.644051 0.794763 -0.395912
O 3.650253 -0.799990 0.396731
O -5.040641 2.216151 -1.923539
O -4.888078 2.767709 0.506294
O 4.891352 -2.774708 -0.505595
O 5.049947 -2.219582 1.923122
C -1.353669 0.304853 -0.328730
C 1.359952 -0.309413 0.333168
C 0.836382 -0.319144 -1.110870
C -0.830146 0.314374 1.115338
C -2.367655 1.418752 -0.621079
C 2.374123 -1.423142 0.625551
C -6.223520 0.634883 -0.208676
C 6.228875 -0.640940 0.202963
C -6.667916 0.448066 1.107143
C 6.781289 0.126141 1.237424
C -6.773593 -0.130436 -1.245700
C 6.669932 -0.456022 -1.114251
C -8.203613 -1.270979 0.348945
C 8.210518 1.261197 -0.361834
C -7.652579 -0.497455 1.386889
C 7.766368 1.071962 0.959455
C -7.758521 -1.077477 -0.971420
C 7.654720 0.488256 -1.397689
C -9.264805 -2.275633 0.643658
C 9.251638 2.284262 -0.664591
H -1.770967 -0.692310 -0.599809
H 1.777107 0.687821 0.604116
H 0.496521 -1.319077 -1.430988
H -0.490453 1.314290 1.435670
H 1.574763 0.080884 -1.829440
H -1.568521 -0.085929 1.833786
H -2.297750 1.740352 -1.682131
H -2.260141 2.292473 0.047525
H 2.264881 -2.298043 -0.041235
H 2.306233 -1.742813 1.687299
H -6.245472 1.051384 1.919693
H 6.443683 -0.020896 2.270434
H -6.434170 0.018891 -2.277789
H 6.244840 -1.059935 -1.924973
H -7.995045 -0.636857 2.411052
H 8.191121 1.665577 1.767475
H -8.183198 -1.668032 -1.781722
H 7.992849 0.627882 -2.423259
H -9.251897 -3.122356 -0.057543
H -10.264717 -1.817482 0.573331
H -9.178008 -2.698391 1.654836
H 9.864893 2.018628 -1.537491
H 9.943730 2.445085 0.174307
H 8.785932 3.258537 -0.885846


%chk=000243942-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000243942

0 1
S -5.043783 1.874524 -0.735405
S 5.062110 -1.894561 0.711895
O 0.063087 1.006160 -1.034972
O -0.051805 -1.045397 0.991682
O -3.578684 0.703817 -0.731391
O 3.589455 -0.733777 0.697150
O -5.297504 2.388837 -2.249802
O -4.821587 2.939737 0.466676
O 4.862768 -2.955141 -0.498173
O 5.301490 -2.414569 2.226735
C -1.215513 0.346783 -0.686021
C 1.226451 -0.385172 0.643295
C 1.192392 0.080225 -0.822408
C -1.181296 -0.119490 0.779469
C -2.291807 1.402457 -0.964130
C 2.304669 -1.438540 0.922670
C -6.324791 0.600913 -0.256421
C 6.336638 -0.606507 0.254442
C -6.562906 0.385383 1.110047
C 6.995372 0.068990 1.293425
C -7.005176 -0.070626 -1.284012
C 6.595158 -0.387937 -1.107815
C -8.268437 -1.275813 0.460404
C 8.269323 1.293632 -0.429517
C -7.547428 -0.564537 1.457018
C 7.971232 1.023231 0.932996
C -7.984006 -1.015304 -0.906956
C 7.576325 0.571371 -1.438063
C -9.345033 -2.270949 0.849639
C 9.295960 2.346368 -0.801801
H -1.366125 -0.534903 -1.345253
H 1.375801 0.497070 1.302112
H 1.090938 -0.800302 -1.493166
H -1.080003 0.760646 1.450773
H 2.098746 0.648751 -1.081887
H -2.087562 -0.688300 1.038574
H -2.219478 1.748938 -2.010489
H -2.183329 2.260179 -0.272308
H 2.202392 -2.294703 0.228005
H 2.229190 -1.788106 1.967791
H -6.011635 0.948100 1.869803
H 6.767118 -0.156694 2.339738
H -6.785828 0.146064 -2.334114
H 6.066522 -0.960226 -1.876487
H -7.756368 -0.756382 2.515400
H 8.506808 1.564328 1.721002
H -8.531837 -1.557665 -1.685637
H 7.805641 0.761040 -2.492608
H -9.451242 -3.071007 0.096964
H -10.328125 -1.769014 0.936466
H -9.130314 -2.741580 1.824442
H 9.794749 2.108295 -1.757014
H 10.072336 2.451010 -0.024575
H 8.814331 3.336260 -0.920594


