B-B-B theta0= 2.05289932288 Ktheta= 0.197581523174
B-B-C theta0= 2.08624096827 Ktheta= 0.315333105014
B-B-Cl theta0= 2.02538090734 Ktheta= 0.321247268994
B-B-F theta0= 2.14814922413 Ktheta= 0.496539367358
B-B-H theta0= 2.15570735751 Ktheta= 0.302187224917
B-B-N theta0= 2.01394799603 Ktheta= 0.241687811975
B-B-O theta0= 2.12886951191 Ktheta= 0.500343247001
B-B-P theta0= 1.61756247378 Ktheta= 0.338196181835
B-B-S theta0= 2.0189376229 Ktheta= 0.389322713295
B-B-Si theta0= 1.95615291319 Ktheta= 0.338914499363
B-C-B theta0= 1.68651632476 Ktheta= 1.18277763618
B-C-C theta0= 1.63617010526 Ktheta= 1.45480863161
B-C-Cl theta0= 1.5425559044 Ktheta= 1.89235954027
B-C-F theta0= 1.62404100285 Ktheta= 0.758293867045
B-C-H theta0= 1.81478310766 Ktheta= 0.352011548448
B-C-N theta0= 1.39508106627 Ktheta= 1.35258630192
B-C-O theta0= 1.61452829559 Ktheta= 0.797332164447
B-C-P theta0= 1.47698457406 Ktheta= 2.0231715236
B-C-S theta0= 1.61610433307 Ktheta= 1.55201424954
B-C-Si theta0= 1.64472301455 Ktheta= 1.87653446525
B-N-B theta0= 1.74906534293 Ktheta= 1.06103268115
B-N-C theta0= 1.67586351524 Ktheta= 1.37069553624
B-N-Cl theta0= 1.56012320381 Ktheta= 2.10265292875
B-N-F theta0= 1.57581027233 Ktheta= 0.988976920937
B-N-H theta0= 2.12135833553 Ktheta= 0.166905397492
B-N-N theta0= 1.44069242177 Ktheta= 1.72522569206
B-N-O theta0= 1.6255414512 Ktheta= 0.838098626752
B-N-P theta0= 1.54158437066 Ktheta= 2.13522392859
B-N-S theta0= 1.66252746168 Ktheta= 1.46551044973
B-N-Si theta0= 1.70215355447 Ktheta= 1.71149370531
B-O-B theta0= 1.77038113211 Ktheta= 0.768420349435
B-O-C theta0= 1.63039269115 Ktheta= 1.89315341487
B-O-Cl theta0= 1.52815951064 Ktheta= 2.94596503653
B-O-F theta0= 1.48744105739 Ktheta= 1.69743948634
B-O-H theta0= 2.60591200233 Ktheta= 0.197400822031
B-O-N theta0= 1.4189940676 Ktheta= 2.58453004573
B-O-O theta0= 1.52281529792 Ktheta= 1.50973968952
B-O-P theta0= 1.52568272422 Ktheta= 3.13318689876
B-O-S theta0= 1.61657065788 Ktheta= 2.04005758108
B-O-Si theta0= 1.6819248297 Ktheta= 2.14028817397
B-P-B theta0= 1.62140481716 Ktheta= 0.689215840912
B-P-C theta0= 1.65818360297 Ktheta= 0.609280340499
B-P-Cl theta0= 1.47461842621 Ktheta= 0.868363683964
B-P-F theta0= 1.61781683906 Ktheta= 0.339624680232
B-P-H theta0= 1.82581344328 Ktheta= 0.257815012025
B-P-N theta0= 1.02765172454 Ktheta= 0.244553473201
B-P-O theta0= 1.70148807706 Ktheta= 0.329064745912
B-P-P theta0= 1.37917549652 Ktheta= 0.678457216625
B-P-S theta0= 1.60195269912 Ktheta= 0.749004300625
B-P-Si theta0= 1.60850949695 Ktheta= 0.913977451802
B-S-B theta0= 1.57907039668 Ktheta= 0.848341761766
B-S-C theta0= 1.51774858191 Ktheta= 1.11040764164
B-S-Cl theta0= 1.40132569952 Ktheta= 1.26070702131
B-S-F theta0= 1.40288377364 Ktheta= 0.517557687851
B-S-H theta0= 1.56752231477 Ktheta= 0.381616887017
B-S-N theta0= 0.926969878617 Ktheta= 0.447526447894
B-S-O theta0= 1.41606323445 Ktheta= 0.481357242412
B-S-P theta0= 1.32740275087 Ktheta= 1.30794853028
B-S-S theta0= 1.49276024723 Ktheta= 1.13305888985
B-S-Si theta0= 1.53244227076 Ktheta= 1.60167920238
B-Si-B theta0= 1.68181537348 Ktheta= 0.482222575532
B-Si-C theta0= 1.75771281942 Ktheta= 0.45362530209
B-Si-Cl theta0= 1.65828141686 Ktheta= 0.464109609491
B-Si-F theta0= 1.85713244197 Ktheta= 0.446186469682
B-Si-H theta0= 1.88662451204 Ktheta= 0.348417229957
B-Si-N theta0= 1.79671672451 Ktheta= 0.259411497911
B-Si-O theta0= 1.83093511008 Ktheta= 0.47053969591
B-Si-P theta0= 1.4371395129 Ktheta= 0.392275701737
B-Si-S theta0= 1.66167954895 Ktheta= 0.622354122512
B-Si-Si theta0= 1.6506784837 Ktheta= 0.657956459209
C+C-C theta0= 3.14158851478 Ktheta= 0.33235977825
C+C-Cl theta0= 3.14159264993 Ktheta= 0.269840000064
C+C-F theta0= 3.14159265362 Ktheta= 0.299324093628
C+C-H theta0= 3.14159265463 Ktheta= 0.25393543434
C+C-N theta0= 3.06584438408 Ktheta= 0.405737482515
C+C-O theta0= 3.06830603215 Ktheta= 0.310734564505
C+C-P theta0= 2.98022685252 Ktheta= 0.32783714089
C+C-S theta0= 3.01382700305 Ktheta= 0.23687827562
C-B-B theta0= 2.08624091414 Ktheta= 0.315333188586
C-B-C theta0= 1.95551804063 Ktheta= 1.41525574282
C-B-Cl theta0= 1.98288650921 Ktheta= 1.30899523791
C-B-F theta0= 2.02759495436 Ktheta= 1.15851565059
C-B-H theta0= 2.08939654582 Ktheta= 0.678758848469
C-B-N theta0= 2.07272839645 Ktheta= 1.12008248937
C-B-O theta0= 2.00530214426 Ktheta= 1.16650915478
C-B-P theta0= 1.97100657114 Ktheta= 1.14406455683
C-B-S theta0= 1.93542605821 Ktheta= 1.20468745563
C-B-Si theta0= 2.02156527056 Ktheta= 0.659359429793
C-C-B theta0= 1.6361701115 Ktheta= 1.45480862208
C-C-C theta0= 1.73120968315 Ktheta= 2.98923156394
C-C-Cl theta0= 1.79574372687 Ktheta= 1.95748650371
C-C-F theta0= 1.84074408322 Ktheta= 1.47915823143
C-C-H theta0= 1.93281765849 Ktheta= 0.829274278062
C-C-N theta0= 1.90531880681 Ktheta= 1.40793191154
C-C-O theta0= 1.79296612635 Ktheta= 1.73123557692
C-C-P theta0= 1.82789484518 Ktheta= 1.46262627235
C-C-S theta0= 1.72769536219 Ktheta= 2.17197357971
C-C-Si theta0= 1.76414867288 Ktheta= 1.5196405402
C-N-B theta0= 1.67586351447 Ktheta= 1.37069556808
C-N-C theta0= 1.72573215331 Ktheta= 3.25973746328
C-N-Cl theta0= 1.81310016202 Ktheta= 1.92440251308
C-N-F theta0= 1.78951856597 Ktheta= 1.77817992708
C-N-H theta0= 1.91595824229 Ktheta= 0.799087502459
C-N-N theta0= 1.87396172515 Ktheta= 1.55828486073
C-N-O theta0= 1.76409784045 Ktheta= 2.00589373585
C-N-P theta0= 1.86514868473 Ktheta= 1.37062165039
C-N-S theta0= 1.73074950936 Ktheta= 2.26752463215
C-N-Si theta0= 1.75534902518 Ktheta= 1.77571474493
C-O-B theta0= 1.63039269307 Ktheta= 1.89315340047
C-O-C theta0= 1.69279400673 Ktheta= 3.90182401124
C-O-Cl theta0= 1.82237843056 Ktheta= 1.82476851727
C-O-F theta0= 1.73960683233 Ktheta= 1.99128969475
C-O-H theta0= 1.86377951006 Ktheta= 0.738203631822
C-O-N theta0= 1.83603441258 Ktheta= 1.65076305031
C-O-O theta0= 1.71332224869 Ktheta= 2.28762026503
C-O-P theta0= 1.87332329871 Ktheta= 1.16904136849
C-O-S theta0= 1.71386773707 Ktheta= 2.36267605952
C-O-Si theta0= 1.70670275963 Ktheta= 2.43631130125
C-P-B theta0= 1.6581836446 Ktheta= 0.609280287959
C-P-C theta0= 1.63609033748 Ktheta= 2.7943300388
C-P-Cl theta0= 1.66088632313 Ktheta= 2.19399515625
C-P-F theta0= 1.68295724815 Ktheta= 1.5994024756
C-P-H theta0= 1.78620400261 Ktheta= 0.79408620462
C-P-N theta0= 1.74152380457 Ktheta= 1.38773775747
C-P-O theta0= 1.65330343002 Ktheta= 1.85061921702
C-P-P theta0= 1.68364612043 Ktheta= 1.66417609887
C-P-S theta0= 1.61344999416 Ktheta= 2.23099806634
C-P-Si theta0= 1.68206767737 Ktheta= 1.29935951724
C-S-B theta0= 1.5177485823 Ktheta= 1.11040764487
C-S-C theta0= 1.57109112406 Ktheta= 3.64869074184
C-S-Cl theta0= 1.62330503383 Ktheta= 2.26912961069
C-S-F theta0= 1.63591452677 Ktheta= 1.6799152246
C-S-H theta0= 1.68129728727 Ktheta= 0.90303439735
C-S-N theta0= 1.67654208106 Ktheta= 1.62090960413
C-S-O theta0= 1.58811111345 Ktheta= 2.0700506479
C-S-P theta0= 1.64224178963 Ktheta= 2.04127771328
C-S-S theta0= 1.56211444304 Ktheta= 2.46596686607
C-S-Si theta0= 1.59327424893 Ktheta= 1.97622800489
C-Si-B theta0= 1.75771278661 Ktheta= 0.45362533808
C-Si-C theta0= 1.68783835777 Ktheta= 2.05067974023
C-Si-Cl theta0= 1.71806946539 Ktheta= 1.65178417564
C-Si-F theta0= 1.79194434917 Ktheta= 1.02235727454
C-Si-H theta0= 1.92345245935 Ktheta= 0.643922224311
C-Si-N theta0= 1.85875406135 Ktheta= 0.886027912933
C-Si-O theta0= 1.75093926301 Ktheta= 1.20544165278
C-Si-P theta0= 1.73489587014 Ktheta= 1.23784369865
C-Si-S theta0= 1.66900570184 Ktheta= 1.66007656622
C-Si-Si theta0= 1.76811663842 Ktheta= 0.800311283899
C=C-B theta0= 1.46367868923 Ktheta= 1.2914694035
C=C-Cl theta0= 2.01897185286 Ktheta= 0.750331170018
C=C-O theta0= 2.06886627221 Ktheta= 0.984056533846
C=C-P theta0= 1.97762249421 Ktheta= 0.667822425684
C=C-S theta0= 1.89908803597 Ktheta= 0.675404023501
C=C-Si theta0= 1.76007552697 Ktheta= 0.697311755474
C=N-B theta0= 2.97607732048 Ktheta= 1.07089103894
C=N-C theta0= 2.97196476029 Ktheta= 1.07195792926
C=N-Cl theta0= 2.95422851688 Ktheta= 1.05922516086
C=N-H theta0= 3.09039498895 Ktheta= 0.245274285872
C=N-P theta0= 2.93423961369 Ktheta= 1.23966924827
C=N-S theta0= 2.93339508495 Ktheta= 0.599582193722
C=N-Si theta0= 2.96915455241 Ktheta= 1.28101190739
Cl-B-B theta0= 2.02538098144 Ktheta= 0.321247286451
Cl-B-C theta0= 1.98288654443 Ktheta= 1.30899514614
Cl-B-Cl theta0= 2.08236793975 Ktheta= 1.22749193431
Cl-B-F theta0= 1.98457215756 Ktheta= 1.38844545083
Cl-B-H theta0= 2.05491004634 Ktheta= 0.74552578588
Cl-B-N theta0= 2.07929390763 Ktheta= 1.26853677792
Cl-B-O theta0= 1.97392915767 Ktheta= 1.38214530201
Cl-B-P theta0= 2.04315123357 Ktheta= 1.13469804711
Cl-B-S theta0= 1.93971126515 Ktheta= 1.26216055118
Cl-B-Si theta0= 2.02449063747 Ktheta= 0.67106746447
Cl-C-B theta0= 1.54255591813 Ktheta= 1.89235931548
Cl-C-C theta0= 1.79574374279 Ktheta= 1.95748639019
Cl-C-Cl theta0= 1.89141943447 Ktheta= 1.49481285835
Cl-C-F theta0= 1.84926574366 Ktheta= 1.53652155517
Cl-C-H theta0= 1.89330327744 Ktheta= 0.860367494255
Cl-C-N theta0= 1.95277012496 Ktheta= 1.60575239951
Cl-C-O theta0= 1.80171310585 Ktheta= 1.78130671191
Cl-C-P theta0= 1.87353822851 Ktheta= 1.34484713653
Cl-C-S theta0= 1.70790190928 Ktheta= 2.33474535217
Cl-C-Si theta0= 1.67711837617 Ktheta= 2.22299655371
Cl-N-B theta0= 1.56012320914 Ktheta= 2.1026528175
Cl-N-C theta0= 1.8131001739 Ktheta= 1.92440236634
Cl-N-Cl theta0= 1.91866395881 Ktheta= 1.50908802887
Cl-N-F theta0= 1.85808598786 Ktheta= 1.61588790316
Cl-N-H theta0= 1.84973201799 Ktheta= 0.86905266282
Cl-N-N theta0= 1.96070510028 Ktheta= 1.82452177451
Cl-N-O theta0= 1.81575897944 Ktheta= 1.85368131782
Cl-N-P theta0= 1.90202909206 Ktheta= 1.35193412971
Cl-N-S theta0= 1.70568759856 Ktheta= 2.4949051421
Cl-N-Si theta0= 1.65932955489 Ktheta= 2.86685958186
Cl-O-B theta0= 1.52815951145 Ktheta= 2.94596497953
Cl-O-C theta0= 1.82237843808 Ktheta= 1.82476843284
Cl-O-Cl theta0= 1.8787332206 Ktheta= 1.35145516067
Cl-O-F theta0= 1.85577408244 Ktheta= 1.5541143956
Cl-O-H theta0= 1.78384612371 Ktheta= 0.839519417712
Cl-O-N theta0= 1.94684201032 Ktheta= 1.70569641769
Cl-O-O theta0= 1.81351243132 Ktheta= 1.78184659365
Cl-O-P theta0= 1.88327455465 Ktheta= 1.39685263055
Cl-O-S theta0= 1.6669393786 Ktheta= 2.93279216159
Cl-O-Si theta0= 1.85540372974 Ktheta= 1.02570713912
Cl-P-B theta0= 1.47461852692 Ktheta= 0.868363533239
Cl-P-C theta0= 1.66088638061 Ktheta= 2.19399480994
Cl-P-Cl theta0= 1.71038758111 Ktheta= 1.87659110743
Cl-P-F theta0= 1.67583868211 Ktheta= 1.8303449205
Cl-P-H theta0= 1.75525027306 Ktheta= 0.802542713641
Cl-P-N theta0= 1.75589746194 Ktheta= 1.46427266828
Cl-P-O theta0= 1.64394018272 Ktheta= 2.15669508442
Cl-P-P theta0= 1.73435465957 Ktheta= 1.40364860324
Cl-P-S theta0= 1.62050942961 Ktheta= 2.21718652905
Cl-P-Si theta0= 1.65711659541 Ktheta= 1.26399817334
Cl-S-B theta0= 1.40132572958 Ktheta= 1.26070692785
Cl-S-C theta0= 1.62330514698 Ktheta= 2.26912884099
Cl-S-Cl theta0= 1.74745456152 Ktheta= 1.38722803349
Cl-S-F theta0= 1.68492882926 Ktheta= 1.44791296774
Cl-S-H theta0= 1.67888644257 Ktheta= 0.823251493517
Cl-S-N theta0= 1.79676527719 Ktheta= 1.34787107231
Cl-S-O theta0= 1.62525925751 Ktheta= 1.81606115056
Cl-S-P theta0= 1.75119489832 Ktheta= 1.42082920447
Cl-S-S theta0= 1.56445878349 Ktheta= 1.81042862394
Cl-S-Si theta0= 1.56869328217 Ktheta= 1.95666856293
Cl-Si-B theta0= 1.65828148999 Ktheta= 0.464109576524
Cl-Si-C theta0= 1.71806952722 Ktheta= 1.65178385314
Cl-Si-Cl theta0= 1.74249496916 Ktheta= 1.59777548011
Cl-Si-F theta0= 1.74754542006 Ktheta= 1.30338907917
Cl-Si-H theta0= 1.88535332654 Ktheta= 0.668849864955
Cl-Si-N theta0= 1.82079548477 Ktheta= 1.05514003686
Cl-Si-O theta0= 1.71936087798 Ktheta= 1.4553109799
Cl-Si-P theta0= 1.77611122369 Ktheta= 1.11659205327
Cl-Si-S theta0= 1.67220519565 Ktheta= 1.65362604928
Cl-Si-Si theta0= 1.76659917514 Ktheta= 0.755279017451
F-B-B theta0= 2.14814925595 Ktheta= 0.496539393592
F-B-C theta0= 2.02759494593 Ktheta= 1.15851563473
F-B-Cl theta0= 1.98457215449 Ktheta= 1.38844549115
F-B-F theta0= 1.92290890186 Ktheta= 2.01330361036
F-B-H theta0= 2.05030261085 Ktheta= 0.875779445131
F-B-N theta0= 2.0013968477 Ktheta= 1.50990734754
F-B-O theta0= 1.9437104972 Ktheta= 1.69640426947
F-B-P theta0= 1.99888195686 Ktheta= 1.1466460124
F-B-S theta0= 1.953724575 Ktheta= 1.12944877109
F-B-Si theta0= 2.0923501844 Ktheta= 0.710187129929
F-C-B theta0= 1.62404100622 Ktheta= 0.758293836436
F-C-C theta0= 1.8407440599 Ktheta= 1.479158084
F-C-Cl theta0= 1.84926574123 Ktheta= 1.53652159384
F-C-F theta0= 1.84621788228 Ktheta= 1.77777535996
F-C-H theta0= 1.89527817489 Ktheta= 1.02480799671
F-C-N theta0= 1.85868932774 Ktheta= 1.71762587913
F-C-O theta0= 1.72121556751 Ktheta= 2.59538844674
F-C-P theta0= 1.86334492272 Ktheta= 1.26071677912
F-C-S theta0= 1.74655573632 Ktheta= 1.56742312582
F-C-Si theta0= 1.80604673431 Ktheta= 0.779864326336
F-N-B theta0= 1.57581027583 Ktheta= 0.988976884922
F-N-C theta0= 1.789518562 Ktheta= 1.77817992861
F-N-Cl theta0= 1.85808598418 Ktheta= 1.61588797257
F-N-F theta0= 1.72803119273 Ktheta= 2.63007786571
F-N-H theta0= 1.81999979929 Ktheta= 1.07104239143
F-N-N theta0= 1.84756878906 Ktheta= 1.96819038798
F-N-O theta0= 1.69579518552 Ktheta= 2.96412350099
F-N-P theta0= 1.85298856583 Ktheta= 1.41952048004
F-N-S theta0= 1.7143985117 Ktheta= 1.81519826761
F-N-Si theta0= 1.71237444552 Ktheta= 1.10674458789
F-O-B theta0= 1.4874410575 Ktheta= 1.69743945976
F-O-C theta0= 1.73960683424 Ktheta= 1.99128968604
F-O-Cl theta0= 1.85577407613 Ktheta= 1.55411451039
F-O-F theta0= 1.77702704285 Ktheta= 1.96151393928
F-O-H theta0= 1.7191294608 Ktheta= 1.05709111483
F-O-N theta0= 1.88990342736 Ktheta= 2.18946666594
F-O-O theta0= 1.69471583152 Ktheta= 2.47432734286
F-O-P theta0= 1.81475107684 Ktheta= 1.51532220841
F-O-S theta0= 1.66401937795 Ktheta= 2.00432969043
F-O-Si theta0= 1.59426463669 Ktheta= 2.0126415348
F-P-B theta0= 1.61781695895 Ktheta= 0.33962465045
F-P-C theta0= 1.68295725081 Ktheta= 1.59940247769
F-P-Cl theta0= 1.6758386797 Ktheta= 1.83034493252
F-P-F theta0= 1.72106132475 Ktheta= 1.4537839264
F-P-H theta0= 1.73340808162 Ktheta= 0.938558381629
F-P-N theta0= 1.68854463549 Ktheta= 1.91335043612
F-P-O theta0= 1.61151823747 Ktheta= 2.68163617804
F-P-P theta0= 1.7047050124 Ktheta= 1.27800249108
F-P-S theta0= 1.61683160587 Ktheta= 1.76493446224
F-P-Si theta0= 1.74647465546 Ktheta= 0.74398394654
F-S-B theta0= 1.40288379886 Ktheta= 0.517557658
F-S-C theta0= 1.63591452718 Ktheta= 1.67991523014
F-S-Cl theta0= 1.68492882227 Ktheta= 1.44791299551
F-S-F theta0= 1.71211380284 Ktheta= 1.3092714759
F-S-H theta0= 1.66803230924 Ktheta= 0.983152387154
F-S-N theta0= 1.66963414117 Ktheta= 1.7622061248
F-S-O theta0= 1.57157171045 Ktheta= 2.574202077
F-S-P theta0= 1.67715285172 Ktheta= 1.41090348146
F-S-S theta0= 1.58295278474 Ktheta= 1.82194013302
F-S-Si theta0= 1.62344534414 Ktheta= 0.893027988764
F-Si-B theta0= 1.85713248287 Ktheta= 0.446186518776
F-Si-C theta0= 1.79194436173 Ktheta= 1.02235723686
F-Si-Cl theta0= 1.74754541513 Ktheta= 1.30338910326
F-Si-F theta0= 1.84037693686 Ktheta= 1.04126083737
F-Si-H theta0= 1.87442289687 Ktheta= 0.726063845574
F-Si-N theta0= 1.88859848093 Ktheta= 0.979614159925
F-Si-O theta0= 1.69047365484 Ktheta= 1.77424865063
F-Si-P theta0= 1.79666935268 Ktheta= 0.87960242292
F-Si-S theta0= 1.7031817977 Ktheta= 1.16409774635
F-Si-Si theta0= 1.8882078947 Ktheta= 0.573064438712
H-B-B theta0= 2.1557073696 Ktheta= 0.302187244607
H-B-C theta0= 2.08939654926 Ktheta= 0.678758853814
H-B-Cl theta0= 2.05491004777 Ktheta= 0.745525795349
H-B-F theta0= 2.05030261203 Ktheta= 0.8757794456
H-B-H theta0= 2.09294024126 Ktheta= 0.549568598035
H-B-N theta0= 2.09769529789 Ktheta= 0.88089075532
H-B-O theta0= 2.03474831694 Ktheta= 0.826817842141
H-B-P theta0= 2.03612085353 Ktheta= 0.671850475778
H-B-S theta0= 1.96633865714 Ktheta= 0.624484491686
H-B-Si theta0= 2.10835859911 Ktheta= 0.444051406561
H-C-B theta0= 1.81478310714 Ktheta= 0.352011548923
H-C-C theta0= 1.93281767721 Ktheta= 0.82927431127
H-C-Cl theta0= 1.89330327859 Ktheta= 0.86036750693
H-C-F theta0= 1.89527817481 Ktheta= 1.02480799661
H-C-H theta0= 1.9135431149 Ktheta= 0.696670818848
H-C-N theta0= 1.9233297653 Ktheta= 1.01481509369
H-C-O theta0= 1.85056346459 Ktheta= 1.02922291174
H-C-P theta0= 1.86845137926 Ktheta= 0.765651826742
H-C-S theta0= 1.79885191929 Ktheta= 0.811264822868
H-C-Si theta0= 1.9179239454 Ktheta= 0.528081381059
H-N-B theta0= 2.12135833995 Ktheta= 0.166905396341
H-N-C theta0= 1.91595824298 Ktheta= 0.799087506844
H-N-Cl theta0= 1.84973202109 Ktheta= 0.869052676778
H-N-F theta0= 1.81999979878 Ktheta= 1.07104238733
H-N-H theta0= 1.89350641642 Ktheta= 0.694395267436
H-N-N theta0= 1.86870611913 Ktheta= 1.00095418425
H-N-O theta0= 1.80511397377 Ktheta= 1.06685765699
H-N-P theta0= 1.85011395823 Ktheta= 0.720896305329
H-N-S theta0= 1.80477374551 Ktheta= 0.79082978033
H-N-Si theta0= 1.95800831453 Ktheta= 0.452196300377
H-O-B theta0= 2.60591200295 Ktheta= 0.197400821642
H-O-C theta0= 1.8637795109 Ktheta= 0.738203634374
H-O-Cl theta0= 1.78384612685 Ktheta= 0.839519418413
H-O-F theta0= 1.71912946004 Ktheta= 1.0570911132
H-O-H theta0= 1.82688507839 Ktheta= 0.670320588307
H-O-N theta0= 1.78555470875 Ktheta= 0.947877603518
H-O-O theta0= 1.71300293036 Ktheta= 1.04507904153
H-O-P theta0= 1.81103528128 Ktheta= 0.604197332111
H-O-S theta0= 1.76256444901 Ktheta= 0.751873904956
H-O-Si theta0= 1.99306786406 Ktheta= 0.280424758473
H-P-B theta0= 1.8258134544 Ktheta= 0.257815041083
H-P-C theta0= 1.78620400589 Ktheta= 0.794086222524
H-P-Cl theta0= 1.7552502717 Ktheta= 0.802542718336
H-P-F theta0= 1.73340808426 Ktheta= 0.938558385143
H-P-H theta0= 1.75980016007 Ktheta= 0.692127986651
H-P-N theta0= 1.80872505249 Ktheta= 0.908514785633
H-P-O theta0= 1.69901348378 Ktheta= 0.992166111928
H-P-P theta0= 1.73981354643 Ktheta= 0.748993131054
H-P-S theta0= 1.63553338248 Ktheta= 0.83372086715
H-P-Si theta0= 1.7869859248 Ktheta= 0.531743635552
H-S-B theta0= 1.56752232135 Ktheta= 0.381616892009
H-S-C theta0= 1.68129729828 Ktheta= 0.903034435816
H-S-Cl theta0= 1.67888644345 Ktheta= 0.823251507071
H-S-F theta0= 1.66803231164 Ktheta= 0.98315238952
H-S-H theta0= 1.62051794905 Ktheta= 0.807967407144
H-S-N theta0= 1.70295800479 Ktheta= 1.00694968294
H-S-O theta0= 1.62078854926 Ktheta= 1.03144848972
H-S-P theta0= 1.63256221643 Ktheta= 0.879569390926
H-S-S theta0= 1.56797961025 Ktheta= 0.873087576549
H-S-Si theta0= 1.63269222173 Ktheta= 0.62253730457
H-Si-B theta0= 1.88662451594 Ktheta= 0.348417236768
H-Si-C theta0= 1.92345246499 Ktheta= 0.643922231205
H-Si-Cl theta0= 1.88535332543 Ktheta= 0.668849865921
H-Si-F theta0= 1.87442289742 Ktheta= 0.726063847857
H-Si-H theta0= 1.91430151359 Ktheta= 0.576734526814
H-Si-N theta0= 1.94870595889 Ktheta= 0.757790536625
H-Si-O theta0= 1.84668532238 Ktheta= 0.742375651195
H-Si-P theta0= 1.86889006514 Ktheta= 0.624035198523
H-Si-S theta0= 1.76068966274 Ktheta= 0.649939349847
H-Si-Si theta0= 1.92679523603 Ktheta= 0.462525220777
N+C-C theta0= 3.14090420403 Ktheta= 0.336143205175
N+C-Cl theta0= 3.14159265362 Ktheta= 0.300616620467
N+C-F theta0= 3.14159265362 Ktheta= 0.336164127365
N+C-H theta0= 3.14159265361 Ktheta= 0.27536087666
N+C-N theta0= 3.05925772589 Ktheta= 0.412153767504
N+C-O theta0= 3.0690171851 Ktheta= 0.341965079947
N+C-P theta0= 2.96705628504 Ktheta= 0.335105014137
N+C-S theta0= 3.01534320658 Ktheta= 0.262898168635
N-B-B theta0= 2.01394807657 Ktheta= 0.241687798785
N-B-C theta0= 2.07272840341 Ktheta= 1.12008250803
N-B-Cl theta0= 2.07929389319 Ktheta= 1.26853679228
N-B-F theta0= 2.00139685504 Ktheta= 1.50990732055
N-B-H theta0= 2.09769529765 Ktheta= 0.880890757543
N-B-N theta0= 2.13782402155 Ktheta= 1.45832069674
N-B-O theta0= 2.00864753737 Ktheta= 1.38910561106
N-B-P theta0= 2.10315854404 Ktheta= 1.19808022724
N-B-S theta0= 1.97000001022 Ktheta= 1.05077115768
N-B-Si theta0= 2.07712584273 Ktheta= 0.659811408609
N-C-B theta0= 1.39508105391 Ktheta= 1.35258642053
N-C-C theta0= 1.9053188105 Ktheta= 1.40793250248
N-C-Cl theta0= 1.9527700831 Ktheta= 1.6057522985
N-C-F theta0= 1.85868933206 Ktheta= 1.71762584606
N-C-H theta0= 1.92332976475 Ktheta= 1.01481509117
N-C-N theta0= 1.96742557696 Ktheta= 1.8043516378
N-C-O theta0= 1.81888169793 Ktheta= 1.81506562491
N-C-P theta0= 1.91704788504 Ktheta= 1.28065291028
N-C-S theta0= 1.76856620033 Ktheta= 1.39966249622
N-C-Si theta0= 1.70825704076 Ktheta= 1.0217850677
N-N-B theta0= 1.44069239758 Ktheta= 1.72522586434
N-N-C theta0= 1.87396172546 Ktheta= 1.5582848565
N-N-Cl theta0= 1.9607050176 Ktheta= 1.82452152887
N-N-F theta0= 1.84756876463 Ktheta= 1.96819040738
N-N-H theta0= 1.86870611829 Ktheta= 1.00095414246
N-N-N theta0= 1.94138112929 Ktheta= 2.05221484337
N-N-O theta0= 1.78951972414 Ktheta= 2.16226264549
N-N-P theta0= 1.90346710006 Ktheta= 1.32406927631
N-N-S theta0= 1.74365461194 Ktheta= 1.56599526946
N-N-Si theta0= 1.64979248575 Ktheta= 1.53135460833
N-O-B theta0= 1.41899406229 Ktheta= 2.58453012622
N-O-C theta0= 1.83603441954 Ktheta= 1.65076303632
N-O-Cl theta0= 1.94684197309 Ktheta= 1.70569633037
N-O-F theta0= 1.88990341909 Ktheta= 2.18946661095
N-O-H theta0= 1.78555470769 Ktheta= 0.94787759942
N-O-N theta0= 1.93159424807 Ktheta= 2.37731425957
N-O-O theta0= 1.81062091822 Ktheta= 2.15111973737
N-O-P theta0= 1.85054067133 Ktheta= 1.20823008907
N-O-S theta0= 1.6859433043 Ktheta= 1.80026855794
N-O-Si theta0= 1.57011782523 Ktheta= 2.69036287126
N-P-B theta0= 1.02765189417 Ktheta= 0.244553737676
N-P-C theta0= 1.74152381368 Ktheta= 1.38773772399
N-P-Cl theta0= 1.75589745323 Ktheta= 1.46427267404
N-P-F theta0= 1.68854463747 Ktheta= 1.91335040016
N-P-H theta0= 1.80872505286 Ktheta= 0.908514781319
N-P-N theta0= 1.79653781039 Ktheta= 1.42342157008
N-P-O theta0= 1.66536155895 Ktheta= 2.04367908601
N-P-P theta0= 1.78538971893 Ktheta= 1.13183310532
N-P-S theta0= 1.64896080985 Ktheta= 1.56567236774
N-P-Si theta0= 1.74761780556 Ktheta= 0.677606473206
N-S-B theta0= 0.926969886688 Ktheta= 0.447526487799
N-S-C theta0= 1.67654210539 Ktheta= 1.62090957572
N-S-Cl theta0= 1.7967652499 Ktheta= 1.34787105042
N-S-F theta0= 1.66963413892 Ktheta= 1.76220610081
N-S-H theta0= 1.70295800414 Ktheta= 1.00694967941
N-S-N theta0= 1.76485699808 Ktheta= 1.61343904352
N-S-O theta0= 1.61682076231 Ktheta= 2.10972198383
N-S-P theta0= 1.72447950002 Ktheta= 1.43777148922
N-S-S theta0= 1.59735407908 Ktheta= 1.27424918836
N-S-Si theta0= 1.57606616354 Ktheta= 0.992953140451
N-Si-B theta0= 1.79671673796 Ktheta= 0.259411435478
N-Si-C theta0= 1.85875408637 Ktheta= 0.886027865679
N-Si-Cl theta0= 1.82079551303 Ktheta= 1.05513993587
N-Si-F theta0= 1.88859848625 Ktheta= 0.979614152071
N-Si-H theta0= 1.94870595669 Ktheta= 0.75779053214
N-Si-N theta0= 1.93344683899 Ktheta= 0.910146237333
N-Si-O theta0= 1.77610548428 Ktheta= 1.21083438163
N-Si-P theta0= 1.88134418367 Ktheta= 0.841785154171
N-Si-S theta0= 1.73977633241 Ktheta= 1.01001076996
N-Si-Si theta0= 1.91767801682 Ktheta= 0.539766227768
N=C-B theta0= 1.97228601314 Ktheta= 0.311781119467
N=C-C theta0= 2.08542427392 Ktheta= 1.36832838107
N=C-Cl theta0= 2.06276188601 Ktheta= 1.47493880945
N=C-F theta0= 2.00962621919 Ktheta= 1.7036985748
N=C-H theta0= 2.07065479851 Ktheta= 1.06953958489
N=C-N theta0= 2.07205111077 Ktheta= 1.61310995201
N=C-O theta0= 2.0145825816 Ktheta= 1.67888094739
N=C-P theta0= 2.02912848403 Ktheta= 1.30259247379
N=C-S theta0= 2.01572597079 Ktheta= 1.28540146912
N=C-Si theta0= 2.0527818782 Ktheta= 0.765711333185
N=N-B theta0= 2.92212640401 Ktheta= 0.784171836668
N=N-C theta0= 1.93883686153 Ktheta= 1.86796722865
N=N-Cl theta0= 1.95234349612 Ktheta= 2.16614826709
N=N-F theta0= 1.89834430426 Ktheta= 2.56649067938
N=N-H theta0= 1.87415463736 Ktheta= 1.18552200062
N=N-N theta0= 1.93080810701 Ktheta= 2.30224826555
N=N-O theta0= 1.86556895405 Ktheta= 2.9198100716
N=N-P theta0= 1.91836121625 Ktheta= 1.53298464904
N=N-S theta0= 1.9060924561 Ktheta= 1.70679136312
N=N-Si theta0= 1.94250997318 Ktheta= 0.676820041449
O-B-B theta0= 2.12886952727 Ktheta= 0.500343216022
O-B-C theta0= 2.0053021377 Ktheta= 1.16650914266
O-B-Cl theta0= 1.97392915338 Ktheta= 1.38214532653
O-B-F theta0= 1.9437104996 Ktheta= 1.69640425882
O-B-H theta0= 2.03474831664 Ktheta= 0.826817842815
O-B-N theta0= 2.00864753234 Ktheta= 1.38910562822
O-B-O theta0= 1.95486938622 Ktheta= 1.54404057254
O-B-P theta0= 1.97965582773 Ktheta= 1.12739903106
O-B-S theta0= 1.94281370989 Ktheta= 1.1309301528
O-B-Si theta0= 2.06083038266 Ktheta= 0.683490391599
O-C-B theta0= 1.61452830244 Ktheta= 0.797332124406
O-C-C theta0= 1.79296608942 Ktheta= 1.73123570984
O-C-Cl theta0= 1.80171309683 Ktheta= 1.78130677905
O-C-F theta0= 1.72121556856 Ktheta= 2.59538843184
O-C-H theta0= 1.8505634646 Ktheta= 1.0292229123
O-C-N theta0= 1.81888166489 Ktheta= 1.81506576439
O-C-O theta0= 1.71516320088 Ktheta= 2.51421704841
O-C-P theta0= 1.82026891635 Ktheta= 1.36777826708
O-C-S theta0= 1.71726619621 Ktheta= 1.74382360304
O-C-Si theta0= 1.75858843845 Ktheta= 0.950450060707
O-N-B theta0= 1.62554146088 Ktheta= 0.838098573081
O-N-C theta0= 1.76409784052 Ktheta= 2.00589375804
O-N-Cl theta0= 1.81575896101 Ktheta= 1.85368143776
O-N-F theta0= 1.69579518629 Ktheta= 2.9641234816
O-N-H theta0= 1.80511397372 Ktheta= 1.06685765545
O-N-N theta0= 1.78951975866 Ktheta= 2.1622625954
O-N-O theta0= 1.68832704692 Ktheta= 2.98262203714
O-N-P theta0= 1.8270042956 Ktheta= 1.45811433017
O-N-S theta0= 1.69934375662 Ktheta= 1.95500463547
O-N-Si theta0= 1.71065751551 Ktheta= 1.19035755279
O-O-B theta0= 1.52281530101 Ktheta= 1.50973963826
O-O-C theta0= 1.71332225379 Ktheta= 2.28762024403
O-O-Cl theta0= 1.81351241268 Ktheta= 1.7818467243
O-O-F theta0= 1.69471583139 Ktheta= 2.47432734164
O-O-H theta0= 1.71300293102 Ktheta= 1.0450790417
O-O-N theta0= 1.81062091595 Ktheta= 2.15111974983
O-O-O theta0= 1.65553442105 Ktheta= 2.89078478211
O-O-P theta0= 1.83959400385 Ktheta= 1.48946987799
O-O-S theta0= 1.6498953911 Ktheta= 2.18753938116
O-O-Si theta0= 1.60551915369 Ktheta= 2.04792168199
O-P-B theta0= 1.70148815294 Ktheta= 0.32906473267
O-P-C theta0= 1.65330342691 Ktheta= 1.85061923328
O-P-Cl theta0= 1.64394017961 Ktheta= 2.15669508345
O-P-F theta0= 1.61151823828 Ktheta= 2.68163616943
O-P-H theta0= 1.69901348185 Ktheta= 0.992166112213
O-P-N theta0= 1.66536155351 Ktheta= 2.04367915539
O-P-O theta0= 1.60397891968 Ktheta= 2.75138644133
O-P-P theta0= 1.67068657964 Ktheta= 1.35942057639
O-P-S theta0= 1.57585893261 Ktheta= 1.62606568671
O-P-Si theta0= 1.70537386086 Ktheta= 0.815208738979
O-S-B theta0= 1.41606324731 Ktheta= 0.481357208035
O-S-C theta0= 1.58811110415 Ktheta= 2.07005070874
O-S-Cl theta0= 1.62525924536 Ktheta= 1.81606121146
O-S-F theta0= 1.57157171071 Ktheta= 2.57420206776
O-S-H theta0= 1.62078854764 Ktheta= 1.03144848944
O-S-N theta0= 1.6168207547 Ktheta= 2.10972210999
O-S-O theta0= 1.55706568157 Ktheta= 2.98023551936
O-S-P theta0= 1.6343226652 Ktheta= 1.51146611008
O-S-S theta0= 1.55320923558 Ktheta= 2.09903858963
O-S-Si theta0= 1.58619073195 Ktheta= 1.0334924371
O-Si-B theta0= 1.83093513669 Ktheta= 0.470539715602
O-Si-C theta0= 1.75093926589 Ktheta= 1.20544161942
O-Si-Cl theta0= 1.71936087024 Ktheta= 1.45531101335
O-Si-F theta0= 1.69047365516 Ktheta= 1.77424865008
O-Si-H theta0= 1.84668531929 Ktheta= 0.742375651528
O-Si-N theta0= 1.77610546774 Ktheta= 1.21083446278
O-Si-O theta0= 1.69063822861 Ktheta= 1.69630498325
O-Si-P theta0= 1.76034490784 Ktheta= 0.948160798318
O-Si-S theta0= 1.67715553347 Ktheta= 1.27134809126
O-Si-Si theta0= 1.84206612162 Ktheta= 0.605162152758
O=C-B theta0= 1.93380492515 Ktheta= 0.296630318217
O=C-C theta0= 2.15019327432 Ktheta= 1.44591221945
O=C-Cl theta0= 2.13091189432 Ktheta= 1.45261347425
O=C-F theta0= 2.07721052206 Ktheta= 1.6163551095
O=C-H theta0= 2.12935105261 Ktheta= 1.19380349889
O=C-N theta0= 2.15830861047 Ktheta= 1.89141620946
O=C-O theta0= 2.05377580807 Ktheta= 1.61494133577
O=C-P theta0= 2.07634634593 Ktheta= 1.33027757708
O=C-S theta0= 2.075082054 Ktheta= 1.28460205782
O=C-Si theta0= 2.11515705456 Ktheta= 0.797343595301
O=N-B theta0= 1.74282495405 Ktheta= 0.117382241184
O=N-C theta0= 1.98162197919 Ktheta= 1.98780260502
O=N-Cl theta0= 2.03156791962 Ktheta= 2.34489096091
O=N-F theta0= 1.9383787173 Ktheta= 2.27640333262
O=N-H theta0= 1.90343328969 Ktheta= 1.41244353244
O=N-N theta0= 1.97121793233 Ktheta= 3.19441146816
O=N-O theta0= 1.92153373767 Ktheta= 2.73888061212
O=N-P theta0= 1.92894348092 Ktheta= 1.07441075668
O=N-S theta0= 1.93877842405 Ktheta= 1.88389863417
O=N-Si theta0= 1.94356153332 Ktheta= 0.723271357376
P-B-B theta0= 1.61756271458 Ktheta= 0.338195306721
P-B-C theta0= 1.9760753702 Ktheta= 1.12638721389
P-B-Cl theta0= 2.04315123732 Ktheta= 1.13469801535
P-B-F theta0= 1.99888196104 Ktheta= 1.14664595618
P-B-H theta0= 2.03612083919 Ktheta= 0.671850474079
P-B-N theta0= 2.10315859376 Ktheta= 1.19808033866
P-B-O theta0= 1.97965584693 Ktheta= 1.12739898528
P-B-P theta0= 2.13665144983 Ktheta= 1.21010863006
P-B-S theta0= 1.88180269731 Ktheta= 1.17095563184
P-B-Si theta0= 1.93501815766 Ktheta= 0.725435510985
P-C-B theta0= 1.47698455124 Ktheta= 2.02317156729
P-C-C theta0= 1.82789472966 Ktheta= 1.46262644619
P-C-Cl theta0= 1.87353817423 Ktheta= 1.3448472396
P-C-F theta0= 1.86334491928 Ktheta= 1.26071676216
P-C-H theta0= 1.86845137504 Ktheta= 0.765651823376
P-C-N theta0= 1.91704794423 Ktheta= 1.28065281966
P-C-O theta0= 1.82026892758 Ktheta= 1.36777823588
P-C-P theta0= 1.87801555405 Ktheta= 1.26411194566
P-C-S theta0= 1.66750540209 Ktheta= 2.34663451932
P-C-Si theta0= 1.65555226795 Ktheta= 2.39266437567
P-N-B theta0= 1.54158435494 Ktheta= 2.13522396453
P-N-C theta0= 1.86514868167 Ktheta= 1.37062160468
P-N-Cl theta0= 1.90202907685 Ktheta= 1.35193414596
P-N-F theta0= 1.85298856326 Ktheta= 1.41952046472
P-N-H theta0= 1.85011395662 Ktheta= 0.720896303479
P-N-N theta0= 1.90346715766 Ktheta= 1.32406903913
P-N-O theta0= 1.82700430193 Ktheta= 1.45811429177
P-N-P theta0= 1.84884757039 Ktheta= 1.35755379543
P-N-S theta0= 1.67505827819 Ktheta= 2.5527659661
P-N-Si theta0= 1.65460684135 Ktheta= 2.97157367824
P-O-B theta0= 1.52568271022 Ktheta= 3.13318705495
P-O-C theta0= 1.87332329474 Ktheta= 1.16904137354
P-O-Cl theta0= 1.8832745453 Ktheta= 1.39685268724
P-O-F theta0= 1.81475107143 Ktheta= 1.51532218576
P-O-H theta0= 1.81103527946 Ktheta= 0.604197334644
P-O-N theta0= 1.85054069775 Ktheta= 1.20822994229
P-O-O theta0= 1.83959401641 Ktheta= 1.4894698576
P-O-P theta0= 1.74848823814 Ktheta= 2.0826379304
P-O-S theta0= 1.63325557545 Ktheta= 3.31682800465
P-O-Si theta0= 1.61680330183 Ktheta= 4.38334366564
P-P-B theta0= 1.37917548689 Ktheta= 0.678457009126
P-P-C theta0= 1.68364613089 Ktheta= 1.66417583733
P-P-Cl theta0= 1.73435461156 Ktheta= 1.40364868164
P-P-F theta0= 1.70470500961 Ktheta= 1.27800246899
P-P-H theta0= 1.73981353952 Ktheta= 0.74899310562
P-P-N theta0= 1.78538973327 Ktheta= 1.1318330887
P-P-O theta0= 1.67068658604 Ktheta= 1.3594205219
P-P-P theta0= 1.7629531892 Ktheta= 1.23470518191
P-P-S theta0= 1.60537069191 Ktheta= 1.81541593472
P-P-Si theta0= 1.63160145049 Ktheta= 1.29544192295
P-S-B theta0= 1.32740273478 Ktheta= 1.30794847143
P-S-C theta0= 1.64224177752 Ktheta= 2.04127761303
P-S-Cl theta0= 1.75119486542 Ktheta= 1.42082921017
P-S-F theta0= 1.67715284855 Ktheta= 1.41090344315
P-S-H theta0= 1.6325622116 Ktheta= 0.879569377393
P-S-N theta0= 1.72447952432 Ktheta= 1.43777147038
P-S-O theta0= 1.63432266707 Ktheta= 1.5114660731
P-S-P theta0= 1.67292662261 Ktheta= 1.89784901089
P-S-S theta0= 1.57373538366 Ktheta= 2.13053564213
P-S-Si theta0= 1.55097838191 Ktheta= 2.11652973272
P-Si-B theta0= 1.43713960687 Ktheta= 0.392275496232
P-Si-C theta0= 1.73489591808 Ktheta= 1.23784329373
P-Si-Cl theta0= 1.77611121752 Ktheta= 1.11659198075
P-Si-F theta0= 1.79666935508 Ktheta= 0.879602381186
P-Si-H theta0= 1.86889006424 Ktheta= 0.62403518563
P-Si-N theta0= 1.88134419683 Ktheta= 0.841785084733
P-Si-O theta0= 1.76034492375 Ktheta= 0.948160708187
P-Si-P theta0= 1.82747808005 Ktheta= 0.917933081896
P-Si-S theta0= 1.64950654277 Ktheta= 1.38664760164
P-Si-Si theta0= 1.71003614403 Ktheta= 0.832455892484
S-B-B theta0= 2.01893795286 Ktheta= 0.389322641269
S-B-C theta0= 1.93542607815 Ktheta= 1.20468735375
S-B-Cl theta0= 1.93971125819 Ktheta= 1.26216056221
S-B-F theta0= 1.95372457455 Ktheta= 1.12944875346
S-B-H theta0= 1.96633865339 Ktheta= 0.624484482809
S-B-N theta0= 1.97000001884 Ktheta= 1.05077115067
S-B-O theta0= 1.94281371304 Ktheta= 1.13093013587
S-B-P theta0= 1.88180268003 Ktheta= 1.17095578101
S-B-S theta0= 1.89274708226 Ktheta= 1.19695172179
S-B-Si theta0= 1.92717176521 Ktheta= 0.814949509186
S-C-B theta0= 1.61610434459 Ktheta= 1.55201409399
S-C-C theta0= 1.72769534858 Ktheta= 2.17197344051
S-C-Cl theta0= 1.70790189704 Ktheta= 2.33474547362
S-C-F theta0= 1.74655573473 Ktheta= 1.56742309782
S-C-H theta0= 1.79885191397 Ktheta= 0.811264820641
S-C-N theta0= 1.76856625191 Ktheta= 1.39966238352
S-C-O theta0= 1.71726620191 Ktheta= 1.74382354984
S-C-P theta0= 1.6675054152 Ktheta= 2.3466344036
S-C-S theta0= 1.64512954094 Ktheta= 2.87078504261
S-C-Si theta0= 1.65617962549 Ktheta= 2.69453077825
S-N-B theta0= 1.66252746423 Ktheta= 1.46551038723
S-N-C theta0= 1.73074949007 Ktheta= 2.26752482008
S-N-Cl theta0= 1.70568759599 Ktheta= 2.49490517059
S-N-F theta0= 1.71439850971 Ktheta= 1.81519825443
S-N-H theta0= 1.80477374388 Ktheta= 0.790829780794
S-N-N theta0= 1.74365466172 Ktheta= 1.56599503385
S-N-O theta0= 1.69934375743 Ktheta= 1.95500460232
S-N-P theta0= 1.67505827809 Ktheta= 2.55276597701
S-N-S theta0= 1.64264453615 Ktheta= 3.26499654543
S-N-Si theta0= 1.66022030658 Ktheta= 3.14124556476
S-O-B theta0= 1.61657065623 Ktheta= 2.04005756156
S-O-C theta0= 1.71386772688 Ktheta= 2.36267615964
S-O-Cl theta0= 1.66693937717 Ktheta= 2.93279218556
S-O-F theta0= 1.66401937281 Ktheta= 2.00432969273
S-O-H theta0= 1.76256444789 Ktheta= 0.751873908029
S-O-N theta0= 1.68594331764 Ktheta= 1.80026846742
S-O-O theta0= 1.64989538994 Ktheta= 2.18753935803
S-O-P theta0= 1.63325557565 Ktheta= 3.31682801788
S-O-S theta0= 1.79603927012 Ktheta= 1.40752360489
S-O-Si theta0= 1.62088368071 Ktheta= 4.35841089259
S-P-B theta0= 1.60195279407 Ktheta= 0.749004091766
S-P-C theta0= 1.61345001445 Ktheta= 2.23099785749
S-P-Cl theta0= 1.62050942535 Ktheta= 2.21718651419
S-P-F theta0= 1.61683160469 Ktheta= 1.76493444429
S-P-H theta0= 1.63553337773 Ktheta= 0.833720860244
S-P-N theta0= 1.64896081752 Ktheta= 1.56567236464
S-P-O theta0= 1.57585893554 Ktheta= 1.62606564405
S-P-P theta0= 1.60537069875 Ktheta= 1.81541601096
S-P-S theta0= 1.57232234873 Ktheta= 2.41154891685
S-P-Si theta0= 1.60428206486 Ktheta= 1.73429858627
S-S-B theta0= 1.49276027144 Ktheta= 1.13305879399
S-S-C theta0= 1.56211446416 Ktheta= 2.46596659614
S-S-Cl theta0= 1.56445877282 Ktheta= 1.8104286592
S-S-F theta0= 1.58295278373 Ktheta= 1.82194011562
S-S-H theta0= 1.56797960489 Ktheta= 0.873087567623
S-S-N theta0= 1.59735409871 Ktheta= 1.27424915148
S-S-O theta0= 1.55320923949 Ktheta= 2.09903855508
S-S-P theta0= 1.57373539026 Ktheta= 2.13053562092
S-S-S theta0= 1.53479027179 Ktheta= 2.69028393746
S-S-Si theta0= 1.5442155764 Ktheta= 2.42771991043
S-Si-B theta0= 1.66167960343 Ktheta= 0.62235411491
S-Si-C theta0= 1.66900572536 Ktheta= 1.66007638664
S-Si-Cl theta0= 1.67220519625 Ktheta= 1.65362601329
S-Si-F theta0= 1.70318179814 Ktheta= 1.16409772761
S-Si-H theta0= 1.76068966123 Ktheta= 0.649939343837
S-Si-N theta0= 1.73977634125 Ktheta= 1.01001075236
S-Si-O theta0= 1.67715553941 Ktheta= 1.27134805086
S-Si-P theta0= 1.64950653414 Ktheta= 1.3866477308
S-Si-S theta0= 1.61888671931 Ktheta= 1.77170508144
S-Si-Si theta0= 1.6600421226 Ktheta= 1.21598592926
Si-B-B theta0= 1.95615277596 Ktheta= 0.338914733858
Si-B-C theta0= 2.02156525031 Ktheta= 0.659359397578
Si-B-Cl theta0= 2.02449062545 Ktheta= 0.67106739016
Si-B-F theta0= 2.09235015799 Ktheta= 0.710187073448
Si-B-H theta0= 2.1083585924 Ktheta= 0.444051397868
Si-B-N theta0= 2.07712578537 Ktheta= 0.659811447876
Si-B-O theta0= 2.06083034559 Ktheta= 0.683490360372
Si-B-P theta0= 1.93501810433 Ktheta= 0.725435641027
Si-B-S theta0= 1.9271716986 Ktheta= 0.814949509083
Si-B-Si theta0= 1.88196168681 Ktheta= 1.1103702557
Si-C-B theta0= 1.6447230037 Ktheta= 1.87653448694
Si-C-C theta0= 1.7641486115 Ktheta= 1.51964130457
Si-C-Cl theta0= 1.67711832368 Ktheta= 2.22299711546
Si-C-F theta0= 1.80604671383 Ktheta= 0.779864367718
Si-C-H theta0= 1.91792394207 Ktheta= 0.528081379466
Si-C-N theta0= 1.70825700442 Ktheta= 1.02178526215
Si-C-O theta0= 1.75858841872 Ktheta= 0.950450123602
Si-C-P theta0= 1.65555226515 Ktheta= 2.39266456086
Si-C-S theta0= 1.65617960833 Ktheta= 2.69453106369
Si-C-Si theta0= 1.6512665485 Ktheta= 4.30046121088
Si-N-B theta0= 1.70215353732 Ktheta= 1.71149380916
Si-N-C theta0= 1.75534902987 Ktheta= 1.77571471231
Si-N-Cl theta0= 1.65932953925 Ktheta= 2.86685979907
Si-N-F theta0= 1.71237443553 Ktheta= 1.10674462372
Si-N-H theta0= 1.95800831373 Ktheta= 0.452196297883
Si-N-N theta0= 1.64979249751 Ktheta= 1.53135454356
Si-N-O theta0= 1.71065750171 Ktheta= 1.19035760264
Si-N-P theta0= 1.65460684389 Ktheta= 2.97157389838
Si-N-S theta0= 1.66022030264 Ktheta= 3.14124568219
Si-N-Si theta0= 1.67832946832 Ktheta= 4.42055377264
Si-O-B theta0= 1.68192481956 Ktheta= 2.14028826556
Si-O-C theta0= 1.70670275816 Ktheta= 2.43631132808
Si-O-Cl theta0= 1.85540370503 Ktheta= 1.02570720928
Si-O-F theta0= 1.59426463099 Ktheta= 2.01264158942
Si-O-H theta0= 1.99306786222 Ktheta= 0.28042476183
Si-O-N theta0= 1.57011782669 Ktheta= 2.69036286198
Si-O-O theta0= 1.60551914679 Ktheta= 2.04792177129
Si-O-P theta0= 1.61680331044 Ktheta= 4.38334364524
Si-O-S theta0= 1.62088367953 Ktheta= 4.35841096432
Si-O-Si theta0= 1.64959022227 Ktheta= 6.17589069494
Si-P-B theta0= 1.60850944805 Ktheta= 0.913977482921
Si-P-C theta0= 1.68206766135 Ktheta= 1.29935945975
Si-P-Cl theta0= 1.65711654041 Ktheta= 1.2639983072
Si-P-F theta0= 1.74647463283 Ktheta= 0.743983934729
Si-P-H theta0= 1.78698592063 Ktheta= 0.531743630571
Si-P-N theta0= 1.74761779351 Ktheta= 0.677606488094
Si-P-O theta0= 1.7053738511 Ktheta= 0.815208730441
Si-P-P theta0= 1.63160141514 Ktheta= 1.29544205573
Si-P-S theta0= 1.60428201728 Ktheta= 1.73429881879
Si-P-Si theta0= 1.59450334856 Ktheta= 2.78491919331
Si-S-B theta0= 1.53244225195 Ktheta= 1.60167926201
Si-S-C theta0= 1.59327421803 Ktheta= 1.97622816065
Si-S-Cl theta0= 1.56869323958 Ktheta= 1.95666884328
Si-S-F theta0= 1.6246948486 Ktheta= 0.894907557312
Si-S-H theta0= 1.63269221864 Ktheta= 0.622537301266
Si-S-N theta0= 1.57606614767 Ktheta= 0.99295319681
Si-S-O theta0= 1.58619072157 Ktheta= 1.03349244815
Si-S-P theta0= 1.55097836871 Ktheta= 2.11652992609
Si-S-S theta0= 1.5442155472 Ktheta= 2.42772021974
Si-S-Si theta0= 1.53749660895 Ktheta= 4.42856930188
Si-Si-B theta0= 1.65067846997 Ktheta= 0.65795644041
Si-Si-C theta0= 1.76811664494 Ktheta= 0.800311154024
Si-Si-Cl theta0= 1.76659912586 Ktheta= 0.755279079422
Si-Si-F theta0= 1.88820787527 Ktheta= 0.573064411715
Si-Si-H theta0= 1.92679523164 Ktheta= 0.462525216728
Si-Si-N theta0= 1.91767799845 Ktheta= 0.539766207965
Si-Si-O theta0= 1.8420661092 Ktheta= 0.605162127386
Si-Si-P theta0= 1.71003606233 Ktheta= 0.832456047468
Si-Si-S theta0= 1.66004208093 Ktheta= 1.21598605954
Si-Si-Si theta0= 1.62370413304 Ktheta= 2.03152736152