24
TS_CCl-PdL1 (VL_PAr3, r0 = 1.3, θ = 120), G = -3499.602033972584
Pd	   1.298621163652	  -0.627119328015	  -3.527776079268
P 	   2.559959401996	  -0.389443604238	  -1.467874770117
Cl	   3.022806341969	  -1.771176287377	  -1.066688972108
Cl	   1.652200966598	   0.216452142503	  -0.421995600445
Cl	   3.733376698354	   0.518177678325	  -1.761198172357
C 	  -0.058388558607	  -2.129737499534	  -4.190489698702
Cl	   0.086964861898	  -0.888452852768	  -5.624514752724
C 	  -1.257573589209	  -2.086334612271	  -3.450647877980
C 	  -1.673873688357	  -3.216739404847	  -2.758930341206
C 	  -0.923469988986	  -4.385905964090	  -2.844423709009
C 	   0.222488388388	  -4.464361618321	  -3.629776829164
C 	   0.645970933164	  -3.343299251941	  -4.331675802633
H 	  -1.843928382042	  -1.167459177930	  -3.408750775953
H 	  -2.589980683513	  -3.193887439741	  -2.165896990448
H 	   0.773186839405	  -5.403570818086	  -3.703109620044
H 	   1.527667235673	  -3.395415541596	  -4.971849811851
O 	  -1.389199542578	  -5.535387721302	  -2.189639313299
S 	  -0.742262805457	  -6.001003124106	  -0.791502127735
O 	  -1.139774491436	  -7.370113670500	  -0.608942958494
O 	   0.621575730612	  -5.550661610123	  -0.671372640520
C 	  -1.759374385046	  -4.988493577446	   0.399372118252
F 	  -1.382984487047	  -3.725253994896	   0.352824297790
F 	  -3.036305747548	  -5.082465643732	   0.088016158860
F 	  -1.561205804726	  -5.465061247387	   1.612451462080
24
TS_CCl-PdL1 (VL_PAr3, r0 = 1.3, θ = 130), G = -3499.601607766672
Pd	   1.300781832230	  -0.619659426506	  -3.517778436648
P 	   2.635895869415	  -0.268297224121	  -1.512534963906
Cl	   3.142774927284	  -1.622031314715	  -1.071397144955
Cl	   1.764619612035	   0.371348142828	  -0.455869532574
Cl	   3.777615125233	   0.644481980563	  -1.900287599282
C 	  -0.046216024608	  -2.131616498499	  -4.154286449643
Cl	   0.087844948770	  -0.895663534352	  -5.605420942779
C 	  -1.245720077930	  -2.087360423943	  -3.415488762400
C 	  -1.672211291320	  -3.222001289229	  -2.736716912524
C 	  -0.929912429599	  -4.395411959748	  -2.832050296182
C 	   0.222583798843	  -4.471599065627	  -3.607890833564
C 	   0.656580440123	  -3.345780673137	  -4.296206558816
H 	  -1.828648566304	  -1.166478411780	  -3.369574326741
H 	  -2.591279425153	  -3.199635520238	  -2.148375428154
H 	   0.768742709476	  -5.412962363438	  -3.687197205037
H 	   1.541630089121	  -3.397248189574	  -4.931874073250
O 	  -1.413569095313	  -5.551273945911	  -2.202007638886
S 	  -0.787797969951	  -6.052879652769	  -0.807036533727
O 	  -1.193546505801	  -7.424009737603	  -0.661753259087
O 	   0.576138522928	  -5.611764840783	  -0.658775851082
C 	  -1.817079142814	  -5.065278268399	   0.393921119872
F 	  -1.445799300912	  -3.800007746195	   0.372647297560
F 	  -3.091403056880	  -5.158757602389	   0.071858785009
F 	  -1.625528581733	  -5.562826603822	   1.599702739732
24
TS_CCl-PdL1 (VL_PAr3, r0 = 1.3, θ = 140), G = -3499.600896625501
Pd	   1.339129965377	  -0.644677023908	  -3.517083206474
P 	   2.700099828426	  -0.126489795777	  -1.555843545797
Cl	   3.321950825754	  -1.415868127248	  -1.071121198068
Cl	   1.808266197110	   0.492235812611	  -0.503937971969
Cl	   3.758303696986	   0.851543856632	  -2.014777322975
C 	  -0.013054516172	  -2.143899285423	  -4.120074898484
Cl	   0.130285298309	  -0.920333148111	  -5.599813108533
C 	  -1.211448753852	  -2.077037986039	  -3.381554989612
C 	  -1.665849755775	  -3.206927084411	  -2.712543070687
C 	  -0.952584594655	  -4.397096824818	  -2.818398791839
C 	   0.202969269962	  -4.492738011908	  -3.587303129497
C 	   0.666841060976	  -3.370547529042	  -4.262413795989
H 	  -1.774701650990	  -1.144145076514	  -3.331756045045
H 	  -2.584967887013	  -3.168687810979	  -2.125131463970
H 	   0.727619848967	  -5.445628034614	  -3.673816145076
H 	   1.553766554023	  -3.437409110371	  -4.894063685072
O 	  -1.473226601229	  -5.547965921357	  -2.209157004459
S 	  -0.852022709702	  -6.113017894564	  -0.836874504248
O 	  -1.282523063570	  -7.481007569999	  -0.740128427629
O 	   0.520199901377	  -5.702523509529	  -0.677760224712
C 	  -1.859107247922	  -5.152550210447	   0.402744466701
F 	  -1.487931306145	  -3.886932933368	   0.401241451501
F 	  -3.138817565645	  -5.239438445857	   0.101021938862
F 	  -1.646700387450	  -5.675572504367	   1.594151866013
24
TS_CCl-PdL1 (VL_PAr3, r0 = 1.3, θ = 150), G = -3499.600185692466
Pd	   1.343798046575	  -0.675139643302	  -3.484416799635
P 	   2.765832353391	   0.015672452228	  -1.595875690680
Cl	   3.385083289904	  -1.227629864579	  -1.000132462143
Cl	   1.903067723656	   0.745092895412	  -0.591618527515
Cl	   3.823302805594	   0.931865040915	  -2.169725001313
C 	   0.012211790415	  -2.151302983840	  -4.066066828223
Cl	   0.158946057755	  -0.920536224315	  -5.580341730414
C 	  -1.192473908324	  -2.077166851552	  -3.339033834259
C 	  -1.671544407827	  -3.210740274006	  -2.693117175258
C 	  -0.975054380473	  -4.409539614748	  -2.810996565663
C 	   0.189231741554	  -4.510429114531	  -3.565754640988
C 	   0.678860819806	  -3.383828724378	  -4.215767218008
H 	  -1.743564576081	  -1.137328616466	  -3.282343883265
H 	  -2.595765322853	  -3.168890100459	  -2.113878950962
H 	   0.701615080864	  -5.469150070325	  -3.660618493567
H 	   1.572900701897	  -3.454029242115	  -4.837119761836
O 	  -1.522302795891	  -5.561110556809	  -2.226618430752
S 	  -0.909371800599	  -6.176833858357	  -0.872661278937
O 	  -1.368637700886	  -7.537554897259	  -0.812120854914
O 	   0.471651480332	  -5.800021942910	  -0.706615086151
C 	  -1.890865342285	  -5.228963880606	   0.395799094580
F 	  -1.512134726261	  -3.965492137985	   0.404824970144
F 	  -3.175595030088	  -5.304536186993	   0.113256112987
F 	  -1.662695493042	  -5.769119772442	   1.576550229696
24
TS_CCl-PdL1 (VL_PAr3, r0 = 1.3, θ = 160), G = -3499.599786230530
Pd	   1.317706923476	  -0.867073701181	  -3.198599777484
P 	   2.866295997361	   0.330976111286	  -1.638329377350
Cl	   3.627175741149	  -0.747244056754	  -0.899949407358
Cl	   2.010241025010	   1.139747410396	  -0.690088009709
Cl	   3.802904274901	   1.218318402486	  -2.426203720087
C 	   0.051315594838	  -2.217937567408	  -3.909884968837
Cl	   0.314475013648	  -0.836633941146	  -5.447201554047
C 	  -1.191464692472	  -2.142064961419	  -3.254697092739
C 	  -1.736041326757	  -3.296858565911	  -2.701876527113
C 	  -1.059803795399	  -4.504749619265	  -2.846467806111
C 	   0.137218623129	  -4.603679924273	  -3.549063691219
C 	   0.693595313040	  -3.454888295605	  -4.103093240954
H 	  -1.717947378623	  -1.189427496879	  -3.172809497969
H 	  -2.685041145781	  -3.262769541268	  -2.163578925309
H 	   0.629472938069	  -5.570533535854	  -3.663964114536
H 	   1.621415066098	  -3.513713868754	  -4.675173812484
O 	  -1.652506618552	  -5.660279355703	  -2.314858483995
S 	  -1.073407522920	  -6.335461218886	  -0.974070186383
O 	  -1.732380307285	  -7.608016425666	  -0.865184971755
O 	   0.356194448644	  -6.175292773808	  -0.881411335716
C 	  -1.820113724126	  -5.225736492832	   0.327174930661
F 	  -1.209243408297	  -4.057109963982	   0.327767934715
F 	  -3.105209856198	  -5.055895920403	   0.089372548070
F 	  -1.658354775792	  -5.810388866569	   1.497798280631
24
TS_CCl-PdL1 (VL_PAr3, r0 = 1.3, θ = 170), G = -3499.600352710400
Pd	   1.339440685331	  -0.858533616435	  -3.179970797781
P 	   2.942074833243	   0.391475187139	  -1.717275746832
Cl	   3.715630447615	  -0.656762521736	  -0.949464838723
Cl	   2.126554424615	   1.258523157464	  -0.784917465142
Cl	   3.862033002329	   1.226111046847	  -2.579017858043
C 	   0.060395901062	  -2.200448496411	  -3.884912806956
Cl	   0.302736716612	  -0.817642486759	  -5.419955371317
C 	  -1.174716527245	  -2.127287646699	  -3.214266632316
C 	  -1.715985590350	  -3.284758919473	  -2.663479378956
C 	  -1.043627410889	  -4.492717379193	  -2.823485995496
C 	   0.148940618045	  -4.588039894077	  -3.534141437798
C 	   0.701393989584	  -3.437119921816	  -4.087394833398
H 	  -1.699929222634	  -1.174751084263	  -3.122888345502
H 	  -2.660419422627	  -3.253541923033	  -2.116997158371
H 	   0.639361333682	  -5.554831478844	  -3.658287546379
H 	   1.623530777802	  -3.494191750011	  -4.668906484830
O 	  -1.635802561039	  -5.654624803942	  -2.306405474095
S 	  -1.067892041710	  -6.340318289828	  -0.966217592886
O 	  -1.643735650023	  -7.656482342275	  -0.926645228093
O 	   0.342296436965	  -6.088950209433	  -0.806348467020
C 	  -1.943841618052	  -5.332228963206	   0.336117688168
F 	  -1.404402166735	  -4.130998299158	   0.409709771415
F 	  -3.223376823820	  -5.226574104264	   0.039637456837
F 	  -1.804163724608	  -5.952019429986	   1.491121736450
24
TS_CCl-PdL1 (VL_PAr3, r0 = 1.3, θ = 180), G = -3499.600237138590
Pd	   1.355970265505	  -0.867011588290	  -3.141955158225
P 	   2.977494130800	   0.445184040158	  -1.753957900382
Cl	   3.783703487074	  -0.558920460436	  -0.961305832108
Cl	   2.173514806756	   1.343389039990	  -0.841278604175
Cl	   3.865095469714	   1.252897025367	  -2.673598426126
C 	   0.071081761914	  -2.198468040914	  -3.857811962829
Cl	   0.313519063016	  -0.814935541181	  -5.385777780687
C 	  -1.164097334346	  -2.125870659547	  -3.186220503558
C 	  -1.710944543936	  -3.285231183529	  -2.645081014490
C 	  -1.043622337920	  -4.494853423074	  -2.813964743571
C 	   0.151164671166	  -4.589236087201	  -3.521046819639
C 	   0.708906145647	  -3.436515621852	  -4.065138907099
H 	  -1.686946231105	  -1.172439422075	  -3.090186566887
H 	  -2.656956677136	  -3.254521971533	  -2.101260893485
H 	   0.638041110370	  -5.557076407880	  -3.651166462026
H 	   1.630949425908	  -3.493466598864	  -4.646889531118
O 	  -1.644353787794	  -5.659333547547	  -2.312835977516
S 	  -1.089497309337	  -6.362993615733	  -0.976657262036
O 	  -1.663196183574	  -7.680587055361	  -0.961136815726
O 	   0.318402634845	  -6.111120303952	  -0.798357370518
C 	  -1.982210752271	  -5.374772240651	   0.329326217381
F 	  -1.444241355359	  -4.174629561010	   0.426942598633
F 	  -3.257934438681	  -5.264935879037	   0.018108355179
F 	  -1.857345614113	  -6.011265065252	   1.476858553940
24
TS_CCl-PdL1 (VL_PAr3, r0 = 1.3, θ = 190), G = -3499.599965470647
Pd	   1.381373001983	  -0.883288189797	  -3.089600034799
P 	   3.013623427894	   0.510954780357	  -1.795991541649
Cl	   3.892398998358	  -0.430660158352	  -1.003747220235
Cl	   2.215878618311	   1.413687380511	  -0.882274502854
Cl	   3.828786644770	   1.315254192721	  -2.783295130771
C 	   0.089831986088	  -2.200488348460	  -3.823253779516
Cl	   0.341628480193	  -0.815991347867	  -5.341170998849
C 	  -1.147137376870	  -2.125395855090	  -3.154067784339
C 	  -1.704972975955	  -3.285407993592	  -2.625864616720
C 	  -1.046381036945	  -4.498606058305	  -2.803815305852
C 	   0.152377033496	  -4.595109935623	  -3.503948507756
C 	   0.721024685351	  -3.441754485425	  -4.035123793240
H 	  -1.664827510784	  -1.169566351563	  -3.053479837063
H 	  -2.653742705785	  -3.252593509100	  -2.086934055536
H 	   0.632914058875	  -5.565309789583	  -3.640194002885
H 	   1.644688726282	  -3.500825906308	  -4.614155639165
O 	  -1.661217855654	  -5.663943590136	  -2.322121912190
S 	  -1.122998372738	  -6.391916261781	  -0.992321277748
O 	  -1.705199767594	  -7.705843063511	  -1.002094159038
O 	   0.284769231571	  -6.151719171059	  -0.797516530898
C 	  -2.022003340058	  -5.417979793062	   0.319800057471
F 	  -1.479113856380	  -4.221984157531	   0.438684437204
F 	  -3.294363576872	  -5.297383759374	  -0.001398335986
F 	  -1.910840110385	  -6.070842797464	   1.459491665346
24
TS_CCl-PdL1 (VL_PAr3, r0 = 1.3, θ = 200), G = -3499.599651897999
Pd	   1.393793834331	  -0.883758492869	  -3.052249978915
P 	   3.044821350800	   0.556162408188	  -1.829683282021
Cl	   3.949214629903	  -0.347296151493	  -1.022183428115
Cl	   2.263895771866	   1.493356346892	  -0.936404329143
Cl	   3.830513855109	   1.323191584513	  -2.869410750845
C 	   0.098994620910	  -2.195930121065	  -3.794588317575
Cl	   0.348928668580	  -0.812632290792	  -5.305920710287
C 	  -1.139526437226	  -2.124045791323	  -3.126944661898
C 	  -1.701391048392	  -3.286622744668	  -2.608967415128
C 	  -1.045102183977	  -4.500086896828	  -2.794122707599
C 	   0.157258077178	  -4.593430823970	  -3.488468638272
C 	   0.729684311926	  -3.437453244371	  -4.009740246001
H 	  -1.657143851662	  -1.168536868183	  -3.022963107805
H 	  -2.652394168818	  -3.255596480144	  -2.073846436772
H 	   0.636651431200	  -5.563547109714	  -3.629566544454
H 	   1.654359386047	  -3.494949332750	  -4.587323177862
O 	  -1.667102351408	  -5.668565432375	  -2.329283901956
S 	  -1.142443920424	  -6.413331390644	  -1.003525849653
O 	  -1.723590823526	  -7.727424371750	  -1.035384229921
O 	   0.263039955198	  -6.174694573573	  -0.791225839628
C 	  -2.056526131819	  -5.455998712708	   0.309944667415
F 	  -1.520849411537	  -4.258341042317	   0.443678400835
F 	  -3.326765984893	  -5.339001661507	  -0.021049818860
F 	  -1.951823172210	  -6.118180975940	   1.444837497411
24
TS_CCl-PdL1 (VL_PAr3, r0 = 1.3, θ = 210), G = -3499.599065150892
Pd	   1.411222710559	  -0.881869036652	  -3.018075102377
P 	   3.076321919636	   0.605268597903	  -1.866542932648
Cl	   4.004984777480	  -0.254424711335	  -1.039275149604
Cl	   2.306338740363	   1.577834506725	  -1.002090226920
Cl	   3.834143305125	   1.330331409551	  -2.956078760262
C 	   0.111085663361	  -2.190887854204	  -3.763473109432
Cl	   0.353672008500	  -0.813115422112	  -5.270810649231
C 	  -1.127539670718	  -2.121237023115	  -3.094623562782
C 	  -1.694087566469	  -3.285845286153	  -2.586771234663
C 	  -1.042329629010	  -4.500317437101	  -2.781630065184
C 	   0.162964153320	  -4.591459825678	  -3.471108720753
C 	   0.739843065131	  -3.433320744754	  -3.982514260106
H 	  -1.644174580360	  -1.165684877382	  -2.986425717545
H 	  -2.646614590060	  -3.255717748856	  -2.054316121695
H 	   0.639758487206	  -5.561939069453	  -3.618623855694
H 	   1.664343159829	  -3.490204244849	  -4.560402298218
O 	  -1.674034074809	  -5.671394711423	  -2.336653861235
S 	  -1.165625713915	  -6.437826552657	  -1.017206399704
O 	  -1.749027417310	  -7.750169291603	  -1.074983299166
O 	   0.237949127109	  -6.205322146036	  -0.786185433894
C 	  -2.093120654383	  -5.497638490595	   0.298728627666
F 	  -1.564141578988	  -4.298662318788	   0.447218262437
F 	  -3.361446467842	  -5.383491389330	  -0.040860772344
F 	  -1.993988766611	  -6.169620501505	   1.428311836283
24
TS_CCl-PdL1 (VL_PAr3, r0 = 1.4, θ = 120), G = -3500.005142846138
Pd	   1.324320338071	  -0.646211430299	  -3.539001872507
P 	   2.479885631326	  -0.327557682253	  -1.456765858191
Cl	   3.071623815193	  -1.696873712493	  -0.985472312404
Cl	   1.478678430969	   0.228107883526	  -0.390604690061
Cl	   3.634871958277	   0.703302863759	  -1.687790651617
C 	  -0.030164865363	  -2.164948170211	  -4.179638540723
Cl	   0.160436490235	  -0.938076801721	  -5.637305329120
C 	  -1.239496956387	  -2.093692931326	  -3.460922957511
C 	  -1.691376052696	  -3.214647385388	  -2.776131144597
C 	  -0.968049210085	  -4.401168033983	  -2.853430434882
C 	   0.191206177911	  -4.504600074455	  -3.615621480973
C 	   0.654311769622	  -3.390113486985	  -4.303580464643
H 	  -1.806570806171	  -1.162394937815	  -3.428985396101
H 	  -2.613748139995	  -3.172976432212	  -2.193983089992
H 	   0.722913596055	  -5.454867430228	  -3.681932614731
H 	   1.549530663451	  -3.459983899385	  -4.922944688202
O 	  -1.482424481923	  -5.535950677939	  -2.209325022455
S 	  -0.824423842962	  -6.076136756678	  -0.844700111657
O 	  -1.386960286053	  -7.381130247413	  -0.628960461203
O 	   0.591726313886	  -5.810194962034	  -0.806045641913
C 	  -1.620698324024	  -4.932513218489	   0.395176240466
F 	  -1.092845574686	  -3.727956189861	   0.297608944152
F 	  -2.918666183359	  -4.867426194565	   0.176000951008
F 	  -1.397584054166	  -5.418704260971	   1.599963820745
24
TS_CCl-PdL1 (VL_PAr3, r0 = 1.4, θ = 130), G = -3500.004568124674
Pd	   1.332338760113	  -0.649681989828	  -3.528887349453
P 	   2.548821519170	  -0.217733644787	  -1.493264417881
Cl	   3.179051790003	  -1.552142261968	  -0.974342264515
Cl	   1.574984268943	   0.379028927511	  -0.424078155198
Cl	   3.679403142126	   0.815567109157	  -1.816405852340
C 	  -0.018593490881	  -2.168831271985	  -4.144869151964
Cl	   0.163957486284	  -0.944651521274	  -5.618257225645
C 	  -1.228366706928	  -2.096381597903	  -3.427385870941
C 	  -1.691125354583	  -3.221743758046	  -2.756815662750
C 	  -0.975808343418	  -4.412336390663	  -2.844473086333
C 	   0.189005129634	  -4.514117101914	  -3.598221664485
C 	   0.662603189587	  -3.395213617047	  -4.272174300466
H 	  -1.791022902700	  -1.162575763986	  -3.390091873497
H 	  -2.616672435622	  -3.180982200648	  -2.179528402596
H 	   0.715765957635	  -5.466643882038	  -3.671130595684
H 	   1.560152622445	  -3.464840322640	  -4.888247021682
O 	  -1.505669865385	  -5.552411042322	  -2.222745848374
S 	  -0.866410785797	  -6.122613183809	  -0.861547130049
O 	  -1.438821460147	  -7.428252120884	  -0.677536381515
O 	   0.550566496712	  -5.865740142927	  -0.802067781443
C 	  -1.671190757036	  -4.998513577321	   0.390379731302
F 	  -1.139939705959	  -3.793778268279	   0.317429649321
F 	  -2.966989164980	  -4.926476810731	   0.161298113186
F 	  -1.459542982047	  -5.505649735057	   1.588569735930
24
TS_CCl-PdL1 (VL_PAr3, r0 = 1.4, θ = 140), G = -3500.003270825128
Pd	   1.295055553077	  -0.866076053324	  -3.255077758829
P 	   2.775475081182	   0.222275303698	  -1.596737567960
Cl	   3.524676014683	  -0.933225752489	  -0.852820077287
Cl	   1.874693782912	   1.008126218495	  -0.586704885442
Cl	   3.809452180259	   1.189884896583	  -2.261840364839
C 	   0.037116063741	  -2.228586913804	  -3.948150214712
Cl	   0.318645305597	  -0.832792364671	  -5.501920191020
C 	  -1.207740883363	  -2.146372378210	  -3.301099017813
C 	  -1.749622751622	  -3.296852483088	  -2.736259663998
C 	  -1.068285371083	  -4.503543180174	  -2.864921574976
C 	   0.125713066608	  -4.608590857079	  -3.571556552170
C 	   0.680148332306	  -3.463996637691	  -4.136567729297
H 	  -1.734048516344	  -1.193145044372	  -3.226518505919
H 	  -2.697318745267	  -3.259278787535	  -2.195985745315
H 	   0.620087809806	  -5.575295509777	  -3.676893487046
H 	   1.609679875249	  -3.525276260459	  -4.705394768807
O 	  -1.649306497571	  -5.650466248362	  -2.303343725636
S 	  -1.042907537948	  -6.296833950408	  -0.959493666964
O 	  -1.717849456591	  -7.555046630466	  -0.797103215259
O 	   0.390888130869	  -6.156876206575	  -0.911329745635
C 	  -1.733928843249	  -5.140113914877	   0.331884898219
F 	  -1.115717745634	  -3.976816470661	   0.274428407676
F 	  -3.025570158713	  -4.968301211410	   0.135588996396
F 	  -1.532838280796	  -5.689513732542	   1.513423348607
24
TS_CCl-PdL1 (VL_PAr3, r0 = 1.4, θ = 150), G = -3500.003610946228
Pd	   1.303281422631	  -0.880052769997	  -3.207155383006
P 	   2.808878439066	   0.283646324018	  -1.627843488501
Cl	   3.545856985836	  -0.833934358267	  -0.816779228131
Cl	   1.933279816827	   1.151946595519	  -0.664247799768
Cl	   3.853241490044	   1.184489508283	  -2.366483625725
C 	   0.043876481662	  -2.227859327996	  -3.921811076457
Cl	   0.330791410122	  -0.822511740166	  -5.465015970687
C 	  -1.201334325998	  -2.146899039918	  -3.274403622755
C 	  -1.748510530949	  -3.300332530185	  -2.720615291219
C 	  -1.071623844837	  -4.508449926086	  -2.859454710670
C 	   0.124465432933	  -4.611542510358	  -3.563012291115
C 	   0.684107547515	  -3.464126336917	  -4.117099346176
H 	  -1.725317917799	  -1.192779006960	  -3.193846243465
H 	  -2.697514897962	  -3.264344081549	  -2.182488780887
H 	   0.615543154320	  -5.579205118513	  -3.675154379010
H 	   1.614092724066	  -3.524081506312	  -4.685473187102
O 	  -1.660130235106	  -5.659033514059	  -2.313488228834
S 	  -1.063691498915	  -6.323737984504	  -0.974232728644
O 	  -1.740450280575	  -7.583547423071	  -0.833261608771
O 	   0.369829902135	  -6.185265751628	  -0.914125840602
C 	  -1.763401854429	  -5.183301077056	   0.326864762880
F 	  -1.139936262827	  -4.021926341498	   0.292229241230
F 	  -3.052340561013	  -5.003215402564	   0.120292521653
F 	  -1.576496189621	  -5.750650849624	   1.502213498652
24
TS_CCl-PdL1 (VL_PAr3, r0 = 1.4, θ = 160), G = -3500.003892996791
Pd	   1.332859750981	  -0.909237331740	  -3.142902655331
P 	   2.852060505340	   0.365842755966	  -1.671925035592
Cl	   3.672721791495	  -0.671011531507	  -0.834420411854
Cl	   1.978248519827	   1.246727652482	  -0.718037892644
Cl	   3.822327660598	   1.269990522736	  -2.502164625592
C 	   0.065016766221	  -2.234329396430	  -3.884823428293
Cl	   0.370497989793	  -0.819637419394	  -5.412899691794
C 	  -1.181034699410	  -2.147407694626	  -3.238677635928
C 	  -1.743008147789	  -3.300893824488	  -2.699952490935
C 	  -1.079438204120	  -4.514909520688	  -2.851616580491
C 	   0.119415554230	  -4.622961565467	  -3.549910102793
C 	   0.693948770090	  -3.475539053988	  -4.088466947389
H 	  -1.695875001312	  -1.188896822026	  -3.150285038086
H 	  -2.693705471627	  -3.260709873728	  -2.165070133198
H 	   0.600457856518	  -5.594669507672	  -3.670566989318
H 	   1.625398681161	  -3.539489660163	  -4.654158296149
O 	  -1.685032040807	  -5.665982887076	  -2.325900634458
S 	  -1.104658628443	  -6.359182635591	  -0.994154914682
O 	  -1.793210083498	  -7.615298431860	  -0.880451258812
O 	   0.329489867866	  -6.234248309510	  -0.920694344693
C 	  -1.805102883020	  -5.234530656943	   0.320116855343
F 	  -1.166872840831	  -4.080681732965	   0.313220766407
F 	  -3.089278660571	  -5.034367284209	   0.102407158415
F 	  -1.638730645440	  -5.825289960570	   1.486941520708
24
TS_CCl-PdL1 (VL_PAr3, r0 = 1.4, θ = 170), G = -3500.004520864248
Pd	   1.363600544524	  -0.895044381507	  -3.146611911126
P 	   2.916792524050	   0.415610045259	  -1.743797975001
Cl	   3.768600125961	  -0.592000869361	  -0.901722946038
Cl	   2.064736927407	   1.318090736984	  -0.790395578053
Cl	   3.856833649547	   1.302609430353	  -2.625859099794
C 	   0.078936811263	  -2.217539645297	  -3.867427414027
Cl	   0.352055427177	  -0.814099949185	  -5.400170547592
C 	  -1.156519017268	  -2.129844844244	  -3.200349882369
C 	  -1.715345546109	  -3.283507216638	  -2.658813130647
C 	  -1.059212287076	  -4.499401804340	  -2.826050180060
C 	   0.133003486231	  -4.607332020249	  -3.535648562585
C 	   0.703837749204	  -3.460138542497	  -4.078358762657
H 	  -1.668608068311	  -1.170638134620	  -3.103685882473
H 	  -2.659998387807	  -3.242921109032	  -2.113341293361
H 	   0.609691011919	  -5.580104114842	  -3.666050861379
H 	   1.627094057462	  -3.525524952266	  -4.657233769673
O 	  -1.667917085730	  -5.654835381950	  -2.314774686639
S 	  -1.100989739862	  -6.363854733114	  -0.985775277777
O 	  -1.717143405941	  -7.661412799373	  -0.943868205335
O 	   0.318674218635	  -6.157152215597	  -0.846887887234
C 	  -1.924545409065	  -5.332728919924	   0.332555098967
F 	  -1.355090814456	  -4.144519909916	   0.391187292351
F 	  -3.207090172194	  -5.197334395179	   0.062747308672
F 	  -1.774900192408	  -5.953088442858	   1.485941346757
24
TS_CCl-PdL1 (VL_PAr3, r0 = 1.4, θ = 180), G = -3500.004536046497
Pd	   1.380607749760	  -0.896651388758	  -3.120566635230
P 	   2.951454832140	   0.460354499564	  -1.780763910330
Cl	   3.836070230090	  -0.509695255514	  -0.928563281913
Cl	   2.111983465127	   1.384633520638	  -0.837192024791
Cl	   3.859731890413	   1.329558108230	  -2.712643798759
C 	   0.089236665748	  -2.213371197670	  -3.844405856182
Cl	   0.356864165123	  -0.813097287220	  -5.372491786841
C 	  -1.145011314221	  -2.126520079386	  -3.173983599043
C 	  -1.707471322623	  -3.281637668689	  -2.639405977255
C 	  -1.055825482826	  -4.498739695645	  -2.815260453769
C 	   0.137354673318	  -4.605607457118	  -3.523388355261
C 	   0.711426522894	  -3.457110371299	  -4.059711431100
H 	  -1.655310573080	  -1.166788898928	  -3.072888999186
H 	  -2.652719351051	  -3.241732865063	  -2.094836349631
H 	   0.611066341978	  -5.579105618465	  -3.659444860089
H 	   1.633566375918	  -3.522496667268	  -4.640410465468
O 	  -1.671107219725	  -5.656742438503	  -2.317989227045
S 	  -1.116283531433	  -6.380116098063	  -0.991795922692
O 	  -1.719556821851	  -7.684309388299	  -0.977170391224
O 	   0.298923077300	  -6.160699250674	  -0.829160528780
C 	  -1.970804289756	  -5.377718955575	   0.328666962566
F 	  -1.412113679558	  -4.186098342588	   0.415520505335
F 	  -3.249609931035	  -5.247838430657	   0.039063857901
F 	  -1.835976065499	  -6.015182942441	   1.474429721714
24
TS_CCl-PdL1 (VL_PAr3, r0 = 1.4, θ = 190), G = -3500.004442198868
Pd	   1.394312685686	  -0.897805949288	  -3.083679378538
P 	   2.987791581924	   0.507555759386	  -1.817577014873
Cl	   3.906297998460	  -0.419342691745	  -0.953388864961
Cl	   2.167377908785	   1.464015367312	  -0.889492304914
Cl	   3.860849559961	   1.344918530756	  -2.810462065333
C 	   0.098421666343	  -2.208359885748	  -3.816025687320
Cl	   0.363394429598	  -0.809852448340	  -5.336354541059
C 	  -1.136899810251	  -2.124869477268	  -3.146077589515
C 	  -1.703052677487	  -3.282665510410	  -2.621460513140
C 	  -1.053675898728	  -4.499933176616	  -2.804914716100
C 	   0.142726049508	  -4.603440570150	  -3.508078892651
C 	   0.720080954897	  -3.452347209215	  -4.035045149828
H 	  -1.647029182283	  -1.165451585312	  -3.041077469986
H 	  -2.650564355637	  -3.244753821399	  -2.080661581048
H 	   0.615277584707	  -5.576810766686	  -3.649271040652
H 	   1.642866282806	  -3.516004865091	  -4.614951982754
O 	  -1.675339642504	  -5.661484128664	  -2.324051615424
S 	  -1.134135510121	  -6.399967971716	  -1.000693977123
O 	  -1.729187612374	  -7.707997504181	  -1.011409283875
O 	   0.277248076342	  -6.173753175305	  -0.815836292484
C 	  -2.014045903634	  -5.421465845013	   0.320771784135
F 	  -1.463242398902	  -4.228369046045	   0.433211344314
F 	  -3.288879316631	  -5.293956497467	   0.012833592646
F 	  -1.894096063312	  -6.074571701187	   1.459300433412
24
TS_CCl-PdL1 (VL_PAr3, r0 = 1.4, θ = 200), G = -3500.004071607840
Pd	   1.396306374789	  -0.885131288336	  -3.044113572039
P 	   3.027337827723	   0.549952532930	  -1.857539301243
Cl	   3.953342100115	  -0.346444096585	  -0.969676033306
Cl	   2.247203941735	   1.569528531446	  -0.962614632545
Cl	   3.886551460100	   1.318537155497	  -2.916084410777
C 	   0.100802952092	  -2.196480340907	  -3.782431728899
Cl	   0.354403294433	  -0.800751361173	  -5.296007358149
C 	  -1.137194416173	  -2.123470881493	  -3.115205812303
C 	  -1.701704154685	  -3.287175075853	  -2.602421227552
C 	  -1.047705243448	  -4.501051114423	  -2.792688278714
C 	   0.154461098405	  -4.594290542996	  -3.487298415093
C 	   0.729641288142	  -3.437222985678	  -4.003359187010
H 	  -1.652631171726	  -1.167244855501	  -3.007178725990
H 	  -2.652714363368	  -3.256476604070	  -2.067349453413
H 	   0.631692193494	  -5.564818215803	  -3.632646635440
H 	   1.654394446153	  -3.494044828032	  -4.580857341240
O 	  -1.671666337397	  -5.669706860875	  -2.332222023267
S 	  -1.147154569491	  -6.421138244508	  -1.009651103864
O 	  -1.729778037858	  -7.734334303333	  -1.047145221459
O 	   0.258646381309	  -6.184523689409	  -0.797437735711
C 	  -2.059819949441	  -5.467621555118	   0.307539455086
F 	  -1.524632980946	  -4.269870963202	   0.442720080585
F 	  -3.330518971708	  -5.350835062271	  -0.021453016583
F 	  -1.952766755110	  -6.132099519667	   1.440728871874
24
TS_CCl-PdL1 (VL_PAr3, r0 = 1.4, θ = 210), G = -3500.003224549796
Pd	   1.411737698637	  -0.879397108480	  -3.008132678845
P 	   3.060945133083	   0.598529510175	  -1.895682207366
Cl	   4.033975794598	  -0.259298836774	  -1.020344817608
Cl	   2.301658927523	   1.634770587504	  -1.002019415430
Cl	   3.865677634896	   1.347376020321	  -3.009912845639
C 	   0.113564658636	  -2.190810818793	  -3.749601403279
Cl	   0.359884654499	  -0.803882090400	  -5.260090275312
C 	  -1.126376409039	  -2.121432982208	  -3.084379929663
C 	  -1.695039212560	  -3.287522925958	  -2.582158566572
C 	  -1.043152383151	  -4.501545351962	  -2.779133157257
C 	   0.164161690076	  -4.591336194746	  -3.465138007318
C 	   0.743190896981	  -3.431754405763	  -3.971020597138
H 	  -1.642711140314	  -1.165918138062	  -2.974615851651
H 	  -2.649176430841	  -3.258788918694	  -2.052607026173
H 	   0.640836521978	  -5.561549355777	  -3.614575888512
H 	   1.669285422331	  -3.487175725166	  -4.546442487719
O 	  -1.676667379360	  -5.673280057639	  -2.339842917853
S 	  -1.171483370600	  -6.445204381521	  -1.021888628530
O 	  -1.754786749368	  -7.757143865604	  -1.086405352876
O 	   0.231489307596	  -6.213340463905	  -0.787059489544
C 	  -2.102118639113	  -5.509100580444	   0.294620717592
F 	  -1.575244854400	  -4.309538988168	   0.445559369187
F 	  -3.370022589306	  -5.396558277436	  -0.046590038455
F 	  -2.003132775624	  -6.182810819886	   1.423068688903
24
TS_CCl-PdL1 (VL_PAr3, r0 = 1.5, θ = 120), G = -3500.311637626663
Pd	   1.330062222732	  -0.944427589204	  -3.124777819304
P 	   2.802779333441	   0.340778973201	  -1.665512327482
Cl	   3.700682741291	  -0.690216811579	  -0.789175239106
Cl	   1.898282563450	   1.228510584946	  -0.650314932339
Cl	   3.796983291427	   1.331198881406	  -2.481668462163
C 	   0.068536388655	  -2.256326763592	  -3.886376476358
Cl	   0.421937551545	  -0.811806694290	  -5.411794810300
C 	  -1.182588105524	  -2.156689012410	  -3.254765624696
C 	  -1.758122048977	  -3.306063324475	  -2.721108790372
C 	  -1.101809214847	  -4.524509083760	  -2.867248808546
C 	   0.098130075421	  -4.643806382554	  -3.561983546590
C 	   0.687504072481	  -3.500433696020	  -4.093386147480
H 	  -1.687930195715	  -1.193067081447	  -3.167124260386
H 	  -2.710529368290	  -3.258300478943	  -2.190153508084
H 	   0.571272448210	  -5.619519227922	  -3.680469123939
H 	   1.623973151918	  -3.570254660718	  -4.649952272874
O 	  -1.711918376822	  -5.666878446031	  -2.328979645716
S 	  -1.116187418897	  -6.355881195090	  -1.000776783941
O 	  -1.834859354187	  -7.591050947463	  -0.851758994183
O 	   0.322057486147	  -6.268919735104	  -0.965789155864
C 	  -1.750135611631	  -5.194272523689	   0.316073542143
F 	  -1.082898472194	  -4.057577514047	   0.273835766403
F 	  -3.034600353268	  -4.964587722673	   0.132785447388
F 	  -1.564126399226	  -5.772613717943	   1.486029166718
24
TS_CCl-PdL1 (VL_PAr3, r0 = 1.5, θ = 130), G = -3500.312090653986
Pd	   1.327066574677	  -0.938217567107	  -3.136425315345
P 	   2.800091342831	   0.333146124808	  -1.664963057781
Cl	   3.688648697998	  -0.713665701233	  -0.797800440661
Cl	   1.895517542327	   1.211196487646	  -0.641428342693
Cl	   3.802585633693	   1.328881926000	  -2.464187864178
C 	   0.066141722276	  -2.254313783675	  -3.891707852495
Cl	   0.413669167821	  -0.812716571846	  -5.421086694625
C 	  -1.184158278705	  -2.155661252840	  -3.258335860693
C 	  -1.756885034428	  -3.305035406674	  -2.721615261535
C 	  -1.098663071632	  -4.522634443578	  -2.866312597303
C 	   0.100716829106	  -4.641030608967	  -3.562151287920
C 	   0.687195681777	  -3.497684591752	  -4.096842008616
H 	  -1.691186964401	  -1.192815390439	  -3.171968465191
H 	  -2.708809677230	  -3.257958984216	  -2.189709683340
H 	   0.575502304811	  -5.616105369016	  -3.679357168751
H 	   1.622983985901	  -3.566975172753	  -4.654622107795
O 	  -1.706668603427	  -5.665340266691	  -2.326397634189
S 	  -1.110476717378	  -6.351615192287	  -0.997017501632
O 	  -1.824978743259	  -7.589310289196	  -0.848452015879
O 	   0.327443754209	  -6.259336898879	  -0.959918698111
C 	  -1.750865855585	  -5.191627000684	   0.318151339196
F 	  -1.087741327629	  -4.052480273362	   0.276420147428
F 	  -3.035886395042	  -4.966756707130	   0.132565174940
F 	  -1.564746161569	  -5.768657235537	   1.488770390103
24
TS_CCl-PdL1 (VL_PAr3, r0 = 1.5, θ = 140), G = -3500.312555109686
Pd	   1.325249750152	  -0.930389844355	  -3.145659262403
P 	   2.802647993052	   0.331016497025	  -1.669384127741
Cl	   3.683386044220	  -0.727947424150	  -0.808980720024
Cl	   1.901705749352	   1.205810499820	  -0.639883563008
Cl	   3.812257136235	   1.326833394884	  -2.459379229601
C 	   0.064398019166	  -2.250945562003	  -3.893958046665
Cl	   0.402947853947	  -0.813517260883	  -5.427168378392
C 	  -1.184878422292	  -2.154216169097	  -3.258143425175
C 	  -1.754464505467	  -3.304144762371	  -2.719253678139
C 	  -1.094182181417	  -4.520680120926	  -2.863707915490
C 	   0.104910881833	  -4.637199257121	  -3.560328082829
C 	   0.688053383602	  -3.493346573009	  -4.097606789846
H 	  -1.694068308869	  -1.192446389528	  -3.172570283616
H 	  -2.706076208507	  -3.258471858890	  -2.186625023674
H 	   0.581597465598	  -5.611418333442	  -3.677048866181
H 	   1.622935019155	  -3.561564130521	  -4.657045236422
O 	  -1.700565797599	  -5.664604393804	  -2.324603315049
S 	  -1.106336460128	  -6.349970055643	  -0.993959638619
O 	  -1.815033775128	  -7.591591915790	  -0.850173895894
O 	   0.330957278284	  -6.250119290583	  -0.950779837206
C 	  -1.758643669766	  -5.195288942541	   0.319884872659
F 	  -1.101199261273	  -4.052719318384	   0.282970456251
F 	  -3.043908279623	  -4.976594888111	   0.128520582665
F 	  -1.575193297379	  -5.773198069979	   1.490490597334
24
TS_CCl-PdL1 (VL_PAr3, r0 = 1.5, θ = 150), G = -3500.312880174469
Pd	   1.329126628164	  -0.925526177410	  -3.144037422233
P 	   2.815119314148	   0.343733563415	  -1.682628808823
Cl	   3.702417026540	  -0.710220455681	  -0.822782574336
Cl	   1.920711745437	   1.223516877306	  -0.651700458795
Cl	   3.819020630274	   1.335836127967	  -2.484546309596
C 	   0.066387993116	  -2.247604613186	  -3.888573593697
Cl	   0.396703520388	  -0.814382708776	  -5.422837089010
C 	  -1.181820183876	  -2.152516334302	  -3.250010851947
C 	  -1.750331640836	  -3.303308794008	  -2.711843883061
C 	  -1.090039774706	  -4.519563645098	  -2.858870565695
C 	   0.109231793641	  -4.634361583149	  -3.555447626730
C 	   0.691050988101	  -3.489701633844	  -4.092433694876
H 	  -1.691999414424	  -1.191342148461	  -3.163578284825
H 	  -2.701920737638	  -3.258780937460	  -2.179016463010
H 	   0.586350152757	  -5.608215679465	  -3.673674735044
H 	   1.625027326371	  -3.557199175248	  -4.653485367220
O 	  -1.697668837964	  -5.665320181442	  -2.325162887851
S 	  -1.109343333010	  -6.355200127506	  -0.994357570010
O 	  -1.812564848476	  -7.601192257983	  -0.862296494932
O 	   0.327036234303	  -6.248081882035	  -0.940419172963
C 	  -1.777523993253	  -5.210907785919	   0.320219699131
F 	  -1.125500504741	  -4.065032628125	   0.294332744788
F 	  -3.062197599082	  -4.997270475301	   0.119541830600
F 	  -1.600776078095	  -5.794071513688	   1.489216773063
24
TS_CCl-PdL1 (VL_PAr3, r0 = 1.5, θ = 160), G = -3500.313121548447
Pd	   1.337502356437	  -0.921693668001	  -3.132738637074
P 	   2.839145984826	   0.369327235008	  -1.705956243831
Cl	   3.743130565460	  -0.665343992896	  -0.840128401586
Cl	   1.957631858046	   1.266739794839	  -0.679156637207
Cl	   3.827851398019	   1.348864313897	  -2.541633242934
C 	   0.070656805192	  -2.242914284315	  -3.875285490884
Cl	   0.390985386032	  -0.812854671082	  -5.407858698336
C 	  -1.176316315435	  -2.150567318904	  -3.233267966766
C 	  -1.744411064285	  -3.303206040570	  -2.698717462681
C 	  -1.084802283949	  -4.519208280390	  -2.851349498122
C 	   0.115055888275	  -4.631064953737	  -3.547336881426
C 	   0.696058932786	  -3.484626035329	  -4.081395787303
H 	  -1.687230900412	  -1.190033737871	  -3.143973966623
H 	  -2.696123522305	  -3.260695333364	  -2.165844257985
H 	   0.592255759521	  -5.604481756436	  -3.669164561476
H 	   1.629020983322	  -3.550658871609	  -4.644345571744
O 	  -1.694983522724	  -5.668142716800	  -2.327624139677
S 	  -1.116593567764	  -6.366141772235	  -0.996860516704
O 	  -1.810669659443	  -7.619205569709	  -0.884854743045
O 	   0.318078155832	  -6.247316777618	  -0.924812529903
C 	  -1.811172439762	  -5.239526893325	   0.318900058208
F 	  -1.167834100284	  -4.088536940894	   0.311828317460
F 	  -3.094515818443	  -5.033706863615	   0.102146057339
F 	  -1.646224471780	  -5.831719034464	   1.485037995249
24
TS_CCl-PdL1 (VL_PAr3, r0 = 1.5, θ = 170), G = -3500.313750077315
Pd	   1.357393886348	  -0.896142021013	  -3.130827395496
P 	   2.909137982827	   0.419461201093	  -1.781891053425
Cl	   3.798825991037	  -0.594128683852	  -0.877164465250
Cl	   2.075332607450	   1.398552959611	  -0.790475040134
Cl	   3.910286718267	   1.321576034149	  -2.687114598940
C 	   0.077526710329	  -2.218702792750	  -3.852931155555
Cl	   0.359155577202	  -0.798728343195	  -5.388574625612
C 	  -1.159829443744	  -2.132317340457	  -3.190812315312
C 	  -1.719904048691	  -3.288530354494	  -2.655582718926
C 	  -1.061842012772	  -4.503096621435	  -2.824504646156
C 	   0.132794314965	  -4.608252259767	  -3.530429169489
C 	   0.704992257322	  -3.458709120103	  -4.066915600270
H 	  -1.672505975584	  -1.173596584300	  -3.092462561549
H 	  -2.666616602440	  -3.250775343590	  -2.113566810041
H 	   0.610473590938	  -5.580270882819	  -3.662593364279
H 	   1.630530426616	  -3.521141430893	  -4.642466706920
O 	  -1.670315659992	  -5.660108409289	  -2.317970416034
S 	  -1.105116089583	  -6.372095797369	  -0.989180772173
O 	  -1.716008006625	  -7.672234155418	  -0.954608701039
O 	   0.313103679106	  -6.159506857197	  -0.844947666643
C 	  -1.937910407046	  -5.348933263806	   0.329718159194
F 	  -1.371644599486	  -4.159564636324	   0.395716771705
F 	  -3.219386615371	  -5.215690788944	   0.054214507494
F 	  -1.791977873921	  -5.973778677233	   1.480977537778
24
TS_CCl-PdL1 (VL_PAr3, r0 = 1.5, θ = 180), G = -3500.313793458295
Pd	   1.374544558848	  -0.897383348559	  -3.105372217650
P 	   2.941496932549	   0.460176385615	  -1.814902673718
Cl	   3.885119841480	  -0.514408491152	  -0.922181438969
Cl	   2.119937625878	   1.442110525601	  -0.816157182366
Cl	   3.890718014704	   1.365594337098	  -2.771502404160
C 	   0.088828515685	  -2.215573933387	  -3.830212104069
Cl	   0.366289771036	  -0.800400078961	  -5.361817370590
C 	  -1.148583058287	  -2.129934998330	  -3.167136849542
C 	  -1.712814845411	  -3.287300366279	  -2.638953678094
C 	  -1.058503410063	  -4.503022277470	  -2.814230751106
C 	   0.138307689201	  -4.607306843983	  -3.516554144634
C 	   0.714252154414	  -3.456707668979	  -4.046587354781
H 	  -1.659936762901	  -1.170784785287	  -3.065982200585
H 	  -2.661116272827	  -3.249956023273	  -2.099636055042
H 	   0.613600484410	  -5.579964977345	  -3.652850914022
H 	   1.639675047179	  -3.519380925666	  -4.622334014259
O 	  -1.674107649717	  -5.662227994536	  -2.321592905240
S 	  -1.122288880126	  -6.387861662074	  -0.994745854894
O 	  -1.723921183835	  -7.692735595312	  -0.984944321448
O 	   0.292094849261	  -6.166537760224	  -0.827941556416
C 	  -1.982124048965	  -5.388681549982	   0.324894518354
F 	  -1.424008463088	  -4.197128476818	   0.416139507162
F 	  -3.259785318704	  -5.258674538798	   0.030640792421
F 	  -1.851179183536	  -6.028623121295	   1.469568366568
24
TS_CCl-PdL1 (VL_PAr3, r0 = 1.5, θ = 190), G = -3500.313573734944
Pd	   1.389195538444	  -0.894533133088	  -3.072949474585
P 	   2.977269882524	   0.503014930854	  -1.852498955322
Cl	   3.964451575801	  -0.431853328181	  -0.964544149147
Cl	   2.177377881942	   1.506200027100	  -0.857348576782
Cl	   3.881296124672	   1.389996375741	  -2.868532034233
C 	   0.098451534349	  -2.209292787907	  -3.801920648239
Cl	   0.368711565796	  -0.798435866338	  -5.327428784153
C 	  -1.139936383550	  -2.127799142613	  -3.139077560959
C 	  -1.706832413795	  -3.287988495679	  -2.620337143547
C 	  -1.053805533313	  -4.503460385620	  -2.802632755657
C 	   0.146539387595	  -4.603625854481	  -3.499431434645
C 	   0.724593789145	  -3.450239086020	  -4.020913938123
H 	  -1.652005655635	  -1.169381599817	  -3.034633850659
H 	  -2.657512802555	  -3.253116503960	  -2.085021521941
H 	   0.621616642821	  -5.575795505383	  -3.640230355267
H 	   1.650586240526	  -3.510807655999	  -4.596004896968
O 	  -1.675324984408	  -5.666647616770	  -2.327031222956
S 	  -1.139066847659	  -6.406171893774	  -1.001643223824
O 	  -1.729757765610	  -7.716008063736	  -1.018346295477
O 	   0.270501677032	  -6.175249302067	  -0.809179619258
C 	  -2.029629063469	  -5.432375529113	   0.316368704648
F 	  -1.481815944389	  -4.238520231318	   0.434854688277
F 	  -3.302555601374	  -5.306781272448	   0.000080558378
F 	  -1.915852437733	  -6.087842248775	   1.454009683366
24
TS_CCl-PdL1 (VL_PAr3, r0 = 1.5, θ = 200), G = -3500.313192036102
Pd	   1.401049237967	  -0.887780647680	  -3.039135553071
P 	   3.009325063307	   0.544012956960	  -1.886660686959
Cl	   4.030166326408	  -0.354510000018	  -0.999470735991
Cl	   2.234469135065	   1.578206381241	  -0.903589358680
Cl	   3.874973397116	   1.399946705628	  -2.961245317791
C 	   0.107541760727	  -2.202242011085	  -3.771608708810
Cl	   0.370352148699	  -0.796803746660	  -5.292101624142
C 	  -1.132813769552	  -2.125876151441	  -3.110811236399
C 	  -1.702182523391	  -3.289210901020	  -2.602328379749
C 	  -1.049487029301	  -4.503985497265	  -2.791039272968
C 	   0.155517039630	  -4.599191933464	  -3.480358137367
C 	   0.735652149325	  -3.442535558023	  -3.992134692886
H 	  -1.646580471773	  -1.168649957284	  -3.003960023327
H 	  -2.655736800897	  -3.257376215260	  -2.071956182370
H 	   0.631259190106	  -5.570493934402	  -3.625182615436
H 	   1.663008501967	  -3.500429981303	  -4.565297039442
O 	  -1.677538868657	  -5.671248525296	  -2.334168241713
S 	  -1.157663459138	  -6.426951677678	  -1.011637264907
O 	  -1.743932614113	  -7.738332811726	  -1.053171902029
O 	   0.248404739233	  -6.194231379664	  -0.796717010623
C 	  -2.070338577043	  -5.472473621977	   0.304995514631
F 	  -1.533065823460	  -4.275659225295	   0.440775983737
F 	  -3.340379774227	  -5.353496554251	  -0.025583162916
F 	  -1.965502570853	  -6.137399882441	   1.437992842147
24
TS_CCl-PdL1 (VL_PAr3, r0 = 1.5, θ = 210), G = -3500.312179989290
Pd	   1.423616123207	  -0.881235704762	  -3.003809282809
P 	   3.043312430389	   0.600194643994	  -1.929081971263
Cl	   4.127822753309	  -0.252347830004	  -1.072734955282
Cl	   2.289414747411	   1.638714878806	  -0.934354340709
Cl	   3.835970393160	   1.451787607823	  -3.062077562164
C 	   0.126357103714	  -2.197823288060	  -3.735938060296
Cl	   0.379892797372	  -0.807574190729	  -5.255527127409
C 	  -1.115344778781	  -2.122711543539	  -3.076049351086
C 	  -1.691226933387	  -3.287153171092	  -2.578107117568
C 	  -1.043654607172	  -4.503522157062	  -2.774387783209
C 	   0.166767934633	  -4.597614306089	  -3.454266523224
C 	   0.753153838873	  -3.439698676697	  -3.955709504636
H 	  -1.628363190396	  -1.165272520928	  -2.967783433206
H 	  -2.647844354093	  -3.255234546373	  -2.053324481544
H 	   0.639982419290	  -5.569524407157	  -3.603376129334
H 	   1.681675075818	  -3.498193271897	  -4.526852029801
O 	  -1.685439850687	  -5.672688376750	  -2.341884384384
S 	  -1.189108636823	  -6.454814286476	  -1.026155613616
O 	  -1.780200665897	  -7.762701650577	  -1.099705059506
O 	   0.214447950924	  -6.232267334486	  -0.786192766719
C 	  -2.118507800244	  -5.518916931953	   0.291262377252
F 	  -1.587876909482	  -4.321290839248	   0.444781675146
F 	  -3.385482340332	  -5.401747502438	  -0.051495108699
F 	  -2.022867093617	  -6.195078763691	   1.418375726988
24
TS_CCl-PdL1 (VL_PAr3, r0 = 1.6, θ = 120), G = -3500.538916532077
Pd	   1.336425565668	  -0.951208005892	  -3.107517342977
P 	   2.805260741648	   0.362853370606	  -1.713370367556
Cl	   3.768829317387	  -0.651442191122	  -0.767578643542
Cl	   1.903585024763	   1.321024061706	  -0.654932664364
Cl	   3.841828136177	   1.388826136054	  -2.563560372200
C 	   0.073954375912	  -2.261534121004	  -3.865922124156
Cl	   0.434406981331	  -0.802285508271	  -5.394405419668
C 	  -1.177513534933	  -2.159328147865	  -3.236906001717
C 	  -1.758645099672	  -3.309856748166	  -2.711648759331
C 	  -1.105985346061	  -4.529584503442	  -2.863179562466
C 	   0.095861818251	  -4.649415409858	  -3.554508227554
C 	   0.690929200336	  -3.505057026733	  -4.077707669949
H 	  -1.679740585004	  -1.194416614356	  -3.145545376338
H 	  -2.712736144330	  -3.262032229436	  -2.183784666851
H 	   0.565845627189	  -5.626102963280	  -3.677287111407
H 	   1.628777199557	  -3.574797201196	  -4.631967442794
O 	  -1.722194473813	  -5.672505269674	  -2.334662901997
S 	  -1.133600347293	  -6.373636806207	  -1.009028613578
O 	  -1.855465788703	  -7.608350008548	  -0.873389676776
O 	   0.304593059781	  -6.289408753953	  -0.967706070498
C 	  -1.771110125172	  -5.220173993197	   0.313295173731
F 	  -1.100362384741	  -4.085191363589	   0.282237179365
F 	  -3.053881297645	  -4.985476618194	   0.124988780633
F 	  -1.592565513468	  -5.807614253773	   1.479695074903
24
TS_CCl-PdL1 (VL_PAr3, r0 = 1.6, θ = 130), G = -3500.539339114711
Pd	   1.334602624008	  -0.948252773240	  -3.127244893347
P 	   2.795371100878	   0.347009088078	  -1.707041432902
Cl	   3.765599799452	  -0.689175287247	  -0.792231572708
Cl	   1.882905572004	   1.260603329895	  -0.618835232436
Cl	   3.824456377931	   1.409480267930	  -2.520495830649
C 	   0.072797601885	  -2.262732476327	  -3.877934388346
Cl	   0.431083243807	  -0.807587978987	  -5.413186645960
C 	  -1.177480826405	  -2.158508299980	  -3.247066868870
C 	  -1.756813554709	  -3.307234032406	  -2.715765457215
C 	  -1.103752090659	  -4.527175827711	  -2.863681510224
C 	   0.096566706785	  -4.649151574079	  -3.557306601974
C 	   0.689929605543	  -3.506615113949	  -4.086443970834
H 	  -1.680066928315	  -1.193525018759	  -3.158572567449
H 	  -2.709778021965	  -3.257770357328	  -2.185999734953
H 	   0.566745702841	  -5.626088146613	  -3.677318105416
H 	   1.626719146597	  -3.578029771216	  -4.642258592204
O 	  -1.718176894487	  -5.668329769584	  -2.329331360077
S 	  -1.126817394856	  -6.364026736591	  -1.002046595639
O 	  -1.846758580091	  -7.599265366290	  -0.861112347372
O 	   0.311298380923	  -6.277583124028	  -0.962912024805
C 	  -1.764587135341	  -5.206936622743	   0.316927078580
F 	  -1.095899442981	  -4.070895304449	   0.280778720158
F 	  -3.047990444879	  -4.975183842523	   0.129431065463
F 	  -1.583458140822	  -5.789739431248	   1.485256062110
24
TS_CCl-PdL1 (VL_PAr3, r0 = 1.6, θ = 140), G = -3500.539742803959
Pd	   1.315583568298	  -0.927451397220	  -3.145990040228
P 	   2.801195215652	   0.323948995290	  -1.710965894659
Cl	   3.831391203153	  -0.754610515727	  -0.918850367008
Cl	   1.920735874189	   1.132990556044	  -0.518621987363
Cl	   3.770599432006	   1.466952827667	  -2.487532279787
C 	   0.064115726512	  -2.256333235135	  -3.886694897506
Cl	   0.411275205651	  -0.807728523100	  -5.432092573209
C 	  -1.190240984072	  -2.161466769590	  -3.262833042570
C 	  -1.759229898937	  -3.312947174692	  -2.726267215274
C 	  -1.091530125513	  -4.526528001844	  -2.861334282025
C 	   0.113916042369	  -4.639857593565	  -3.547332019970
C 	   0.696430822307	  -3.494642417074	  -4.082853207697
H 	  -1.704001572315	  -1.201587227166	  -3.184085405153
H 	  -2.715830129718	  -3.270582741439	  -2.202460042255
H 	   0.595863140726	  -5.612175132690	  -3.657734413410
H 	   1.636201796261	  -3.559794182273	  -4.634411803825
O 	  -1.696667762583	  -5.671201876299	  -2.323947308570
S 	  -1.112229998151	  -6.348617448098	  -0.984211256860
O 	  -1.813714840736	  -7.594624399537	  -0.844720183727
O 	   0.323679177598	  -6.237970818013	  -0.926051343942
C 	  -1.787629638701	  -5.193931688124	   0.317810930171
F 	  -1.139296919590	  -4.046190612964	   0.282726260558
F 	  -3.072375494339	  -4.986816102436	   0.111610632445
F 	  -1.611743432916	  -5.765548691417	   1.492448934798
24
TS_CCl-PdL1 (VL_PAr3, r0 = 1.6, θ = 150), G = -3500.540082277345
Pd	   1.320190156768	  -0.923723785985	  -3.143545381366
P 	   2.812209840679	   0.337017709562	  -1.722462593569
Cl	   3.849866355660	  -0.735046356108	  -0.931240098127
Cl	   1.938201505277	   1.151367816311	  -0.528995064569
Cl	   3.774249075625	   1.477391344902	  -2.511988340054
C 	   0.066762283352	  -2.253775670559	  -3.881203191341
Cl	   0.407196316792	  -0.809341715669	  -5.427423071730
C 	  -1.186645991592	  -2.159983052010	  -3.254856441449
C 	  -1.755215219693	  -3.312114811013	  -2.719250171525
C 	  -1.088103723180	  -4.525739535035	  -2.857007738820
C 	   0.117465714974	  -4.637901249419	  -3.542966259497
C 	   0.699358578857	  -3.492082750147	  -4.077857135396
H 	  -1.700904607496	  -1.200444618435	  -3.175117331469
H 	  -2.711768121344	  -3.270501744343	  -2.195239416602
H 	   0.599326720159	  -5.610100166219	  -3.655031024531
H 	   1.638296627739	  -3.556906948422	  -4.630887149026
O 	  -1.694920997274	  -5.671929322870	  -2.324827089886
S 	  -1.116042143619	  -6.354116785058	  -0.985207087392
O 	  -1.813364317744	  -7.603612100085	  -0.856330238518
O 	   0.319036467486	  -6.237969271844	  -0.917651718014
C 	  -1.804636832875	  -5.208576233247	   0.317773839295
F 	  -1.160151190973	  -4.058441831147	   0.292833034675
F 	  -3.088568742165	  -5.004748845631	   0.103277235698
F 	  -1.635341348246	  -5.785434246912	   1.490809626107
24
TS_CCl-PdL1 (VL_PAr3, r0 = 1.6, θ = 160), G = -3500.540442945882
Pd	   1.339367270167	  -0.925987837068	  -3.117337438310
P 	   2.839191874915	   0.385964194543	  -1.751826980348
Cl	   3.803285924367	  -0.641033739960	  -0.820202804913
Cl	   1.967775404400	   1.355397867379	  -0.678450434999
Cl	   3.876344881465	   1.396817684692	  -2.619074195907
C 	   0.073461470337	  -2.246774393047	  -3.856817732982
Cl	   0.399971453105	  -0.801458697619	  -5.392915367780
C 	  -1.174133434097	  -2.153343353778	  -3.217805998187
C 	  -1.745819605738	  -3.307711109438	  -2.690658785382
C 	  -1.087722088812	  -4.523973593137	  -2.847583246895
C 	   0.114133995438	  -4.634968115315	  -3.540228722277
C 	   0.698880499052	  -3.486960242573	  -4.067081049598
H 	  -1.683371772221	  -1.192215662028	  -3.125419091737
H 	  -2.699110746510	  -3.266166398646	  -2.160636249901
H 	   0.589844280312	  -5.608648694518	  -3.665546540164
H 	   1.633382855299	  -3.551647480862	  -4.627633807632
O 	  -1.701526227996	  -5.673966069829	  -2.332124271207
S 	  -1.128935165632	  -6.380723795423	  -1.002829823395
O 	  -1.821660780557	  -7.635499886251	  -0.903767598845
O 	   0.305108415402	  -6.259687910909	  -0.922985497137
C 	  -1.832704089899	  -5.263162567916	   0.315891992977
F 	  -1.190107201447	  -4.111680915220	   0.319317510359
F 	  -3.114720692525	  -5.057044924597	   0.092075750137
F 	  -1.674440111712	  -5.862238527870	   1.479247577073
24
TS_CCl-PdL1 (VL_PAr3, r0 = 1.6, θ = 170), G = -3500.540977886089
Pd	   1.358629792492	  -0.903609554476	  -3.121293188853
P 	   2.897176778462	   0.424628195818	  -1.814149867077
Cl	   3.858294267740	  -0.585529883168	  -0.861281991071
Cl	   2.064130190685	   1.451783767809	  -0.764327008563
Cl	   3.937859647158	   1.381348219418	  -2.736946481268
C 	   0.080471751421	  -2.225947700692	  -3.840800674502
Cl	   0.374333289755	  -0.790730630298	  -5.381431191164
C 	  -1.158368781330	  -2.136224331618	  -3.183680571724
C 	  -1.723379404607	  -3.292734394238	  -2.653970680199
C 	  -1.067507558160	  -4.508287182452	  -2.824080093082
C 	   0.128917957948	  -4.615044882334	  -3.526703242044
C 	   0.706349257708	  -3.465325480166	  -4.057515906720
H 	  -1.668481056644	  -1.176278163035	  -3.084077506763
H 	  -2.671819903640	  -3.254227601008	  -2.115101472532
H 	   0.604224748149	  -5.587951386893	  -3.660570732632
H 	   1.633885938393	  -3.528163201944	  -4.629769525728
O 	  -1.679791624431	  -5.664262589138	  -2.321311356572
S 	  -1.116789280303	  -6.382464167627	  -0.994236192089
O 	  -1.733841970326	  -7.679668477254	  -0.962901009379
O 	   0.302533564029	  -6.176498489103	  -0.851187150035
C 	  -1.943885277232	  -5.357618624565	   0.327108193031
F 	  -1.373181049204	  -4.170310518707	   0.392720138161
F 	  -3.225234383929	  -5.219755239988	   0.053642172120
F 	  -1.798030486983	  -5.983841853744	   1.477472531626
24
TS_CCl-PdL1 (VL_PAr3, r0 = 1.6, θ = 180), G = -3500.540986213802
Pd	   1.374927701535	  -0.901963902779	  -3.097388628980
P 	   2.931034966501	   0.462135153071	  -1.847751940656
Cl	   3.953822421945	  -0.510731819359	  -0.920756181084
Cl	   2.114849684664	   1.485304427711	  -0.780940648338
Cl	   3.911522783437	   1.430179552935	  -2.823417125509
C 	   0.091223272641	  -2.221508227149	  -3.817991857940
Cl	   0.378597092438	  -0.792707288643	  -5.355239589960
C 	  -1.148169048865	  -2.133818143046	  -3.160674186987
C 	  -1.716176540484	  -3.291879161630	  -2.637804225956
C 	  -1.062376839687	  -4.507844596339	  -2.813119179769
C 	   0.136907212790	  -4.612548949712	  -3.511072854900
C 	   0.716813582668	  -3.461375157706	  -4.035847415250
H 	  -1.658238905535	  -1.174049948567	  -3.059145120112
H 	  -2.666691534796	  -3.254682109690	  -2.102464610616
H 	   0.611254952521	  -5.585518401040	  -3.648154722202
H 	   1.644599917338	  -3.523676181240	  -4.607786904221
O 	  -1.680717423632	  -5.666609334340	  -2.324460401077
S 	  -1.132228648631	  -6.396439737537	  -0.997859791005
O 	  -1.735899600553	  -7.700262313198	  -0.992466967401
O 	   0.282154660262	  -6.177205103233	  -0.828692396147
C 	  -1.992983427047	  -5.398128446588	   0.321940194295
F 	  -1.433479241834	  -4.207377940587	   0.415194656827
F 	  -3.269915580559	  -5.266329276275	   0.025705579607
F 	  -1.864335049975	  -6.039677264462	   1.465801510312
24
TS_CCl-PdL1 (VL_PAr3, r0 = 1.6, θ = 190), G = -3500.540832093945
Pd	   1.387913279041	  -0.894465732505	  -3.067968310477
P 	   2.964844757255	   0.502448394094	  -1.883838917417
Cl	   4.004641514162	  -0.433126187407	  -0.937707276123
Cl	   2.172919235496	   1.574466013285	  -0.847187429749
Cl	   3.927827147848	   1.424969159379	  -2.919396320040
C 	   0.098867027222	  -2.212688993472	  -3.789336722317
Cl	   0.374140912783	  -0.789007056871	  -5.321022915838
C 	  -1.140601573489	  -2.130325915076	  -3.130423985989
C 	  -1.709898700500	  -3.291795447982	  -2.616938448518
C 	  -1.056981923690	  -4.507042029658	  -2.800943796440
C 	   0.145131180242	  -4.606441935622	  -3.494696663474
C 	   0.725710002500	  -3.451860887828	  -4.011038771891
H 	  -1.651902875780	  -1.171693625119	  -3.024497482464
H 	  -2.662179122048	  -3.257860257678	  -2.084494515116
H 	   0.619699897397	  -5.578541962470	  -3.637434181235
H 	   1.653309240680	  -3.511220700603	  -4.583615903126
O 	  -1.680326878351	  -5.670519169134	  -2.330072732616
S 	  -1.146373796127	  -6.415410312658	  -1.006121507915
O 	  -1.737978951631	  -7.724626785202	  -1.028529090257
O 	   0.263041898213	  -6.185650659515	  -0.811504497981
C 	  -2.038358744408	  -5.444596040767	   0.313161866702
F 	  -1.490939920118	  -4.250749089855	   0.433775681929
F 	  -3.310944767041	  -5.319016589548	  -0.004147931900
F 	  -1.925062432503	  -6.101958357180	   1.449587045175
24
TS_CCl-PdL1 (VL_PAr3, r0 = 1.6, θ = 200), G = -3500.540540361313
Pd	   1.400731002548	  -0.885650165787	  -3.035907546904
P 	   2.994911445981	   0.544429484516	  -1.915552983267
Cl	   4.032091767606	  -0.344744260922	  -0.923174994741
Cl	   2.223501835028	   1.688021109492	  -0.941929891585
Cl	   3.959551063241	   1.391065991884	  -3.012731430321
C 	   0.107230130453	  -2.203645511553	  -3.758189778027
Cl	   0.372071076139	  -0.786146602982	  -5.284972641149
C 	  -1.131977993389	  -2.125624287045	  -3.097198572208
C 	  -1.703923024747	  -3.290121739774	  -2.593924082843
C 	  -1.053978839032	  -4.505355556478	  -2.788627543579
C 	   0.150566424389	  -4.600478918653	  -3.478698547185
C 	   0.733491578539	  -3.442762228390	  -3.985072132761
H 	  -1.643338095181	  -1.167646479139	  -2.985870569114
H 	  -2.657327122248	  -3.258532466671	  -2.063335615637
H 	   0.623783119521	  -5.572179855641	  -3.628722473170
H 	   1.660605064401	  -3.499883948854	  -4.558629276394
O 	  -1.684638533399	  -5.672715730515	  -2.337315704655
S 	  -1.164177172166	  -6.438830191498	  -1.020376125035
O 	  -1.752505593388	  -7.748843845558	  -1.070506466417
O 	   0.242406897143	  -6.209216824786	  -0.806268527261
C 	  -2.074231916475	  -5.491079269598	   0.302759388490
F 	  -1.537486515567	  -4.294392320218	   0.441756481977
F 	  -3.344971043408	  -5.371855758453	  -0.024471877218
F 	  -1.965889148838	  -6.160524792771	   1.432568101939
24
TS_CCl-PdL1 (VL_PAr3, r0 = 1.6, θ = 210), G = -3500.539541317933
Pd	   1.431549012080	  -0.883827919424	  -3.002829302818
P 	   3.026453065566	   0.602121483467	  -1.956855662898
Cl	   4.226491061268	  -0.242274955378	  -1.121430065603
Cl	   2.282660113901	   1.644728269624	  -0.856573552586
Cl	   3.804820234975	   1.563499554663	  -3.106381548109
C 	   0.137342572968	  -2.207260650878	  -3.724934235356
Cl	   0.401941774609	  -0.812885040079	  -5.255894346842
C 	  -1.106983271461	  -2.125907982992	  -3.072539338580
C 	  -1.689885175679	  -3.288405199098	  -2.577932294581
C 	  -1.045700339819	  -4.506961010764	  -2.771167870965
C 	   0.168210934990	  -4.605703925732	  -3.444097882093
C 	   0.761973001173	  -3.449783890290	  -3.941686155889
H 	  -1.617105098168	  -1.166633017879	  -2.967258953379
H 	  -2.649272299897	  -3.253160092257	  -2.058518601789
H 	   0.638499218546	  -5.579237910150	  -3.591507912031
H 	   1.693632191489	  -3.511508059470	  -4.507280686246
O 	  -1.694927619929	  -5.673091222851	  -2.343405558673
S 	  -1.205748761818	  -6.463743533689	  -1.029554852357
O 	  -1.803663317587	  -7.767996164978	  -1.110401528440
O 	   0.198377321321	  -6.249220101716	  -0.785849350375
C 	  -2.133364469597	  -5.527251710448	   0.288567228448
F 	  -1.601018437258	  -4.330179666255	   0.441127410542
F 	  -3.400268980595	  -5.408716681056	  -0.053545413722
F 	  -2.037516323958	  -6.203314741793	   1.415557667272
24
TS_CCl-PdL1 (VL_PAr3, r0 = 1.7, θ = 120), G = -3500.697178238781
Pd	   1.329348266856	  -0.939712110883	  -3.087715520436
P 	   2.815729138200	   0.387690740265	  -1.770510664634
Cl	   3.788336173052	  -0.620131580610	  -0.705422922851
Cl	   1.952309449366	   1.499136565605	  -0.714664672328
Cl	   3.960195013183	   1.371230983274	  -2.674522165084
C 	   0.069084882510	  -2.256634601370	  -3.837145060065
Cl	   0.423329875787	  -0.780867411792	  -5.368804945327
C 	  -1.183506164154	  -2.161461967820	  -3.211097363110
C 	  -1.762692744374	  -3.318193474901	  -2.697345601944
C 	  -1.105198470621	  -4.534467659976	  -2.856029548792
C 	   0.100625869612	  -4.645029658585	  -3.541796975603
C 	   0.693550792366	  -3.494646457854	  -4.054404825224
H 	  -1.689222510849	  -1.198891232425	  -3.114647244739
H 	  -2.719629332644	  -3.278005531966	  -2.174072440313
H 	   0.574582210005	  -5.619060921610	  -3.670139936559
H 	   1.633471255362	  -3.556777775870	  -4.606068603722
O 	  -1.721360634810	  -5.683583311508	  -2.343016430154
S 	  -1.141768410113	  -6.396313847042	  -1.018989217289
O 	  -1.854384102468	  -7.638632295808	  -0.907181897275
O 	   0.295050975089	  -6.299459003125	  -0.960704861404
C 	  -1.804979220443	  -5.262835457665	   0.307823646177
F 	  -1.143377809467	  -4.122151891763	   0.296509762247
F 	  -3.087113044296	  -5.036731877274	   0.105704690610
F 	  -1.635885050001	  -5.861184388697	   1.469849990741
24
TS_CCl-PdL1 (VL_PAr3, r0 = 1.7, θ = 130), G = -3500.697520362688
Pd	   1.329247623207	  -0.941280121305	  -3.122275412687
P 	   2.799341311912	   0.357545597819	  -1.757716778974
Cl	   3.856881232734	  -0.691183050518	  -0.820643415093
Cl	   1.907849089832	   1.309150117412	  -0.576427340455
Cl	   3.859671605256	   1.488026580258	  -2.589349314682
C 	   0.071809410770	  -2.264535376971	  -3.860334490459
Cl	   0.430506840096	  -0.796086492008	  -5.405839656166
C 	  -1.181133821456	  -2.163363039593	  -3.236467063181
C 	  -1.760061464022	  -3.315436853457	  -2.711813999771
C 	  -1.101980107266	  -4.532846695950	  -2.858730273244
C 	   0.103301536606	  -4.649720618442	  -3.544433545941
C 	   0.696096892034	  -3.504037435761	  -4.067779501824
H 	  -1.686873741493	  -1.199986669599	  -3.148815982004
H 	  -2.716875077066	  -3.270545124089	  -2.188698177844
H 	   0.577203706354	  -5.624860594424	  -3.664130570980
H 	   1.636125863505	  -3.570990380186	  -4.618665513480
O 	  -1.716797154714	  -5.676988658508	  -2.333129800279
S 	  -1.135422720379	  -6.375147721698	  -1.002020319763
O 	  -1.848415243062	  -7.615797275592	  -0.875189860859
O 	   0.301517784989	  -6.278307357207	  -0.947044595873
C 	  -1.796430922371	  -5.227197703692	   0.313480326306
F 	  -1.134699113092	  -4.086796162589	   0.289033134921
F 	  -3.078861420874	  -5.003139561176	   0.111047493501
F 	  -1.625505704323	  -5.813189572120	   1.481551851752
24
TS_CCl-PdL1 (VL_PAr3, r0 = 1.7, θ = 140), G = -3500.697904689293
Pd	   1.327164574004	  -0.934495528156	  -3.130764599107
P 	   2.802353120343	   0.355283829543	  -1.762916534288
Cl	   3.857516161968	  -0.707205394285	  -0.838674542142
Cl	   1.914951474690	   1.295619889032	  -0.569557931321
Cl	   3.865209436601	   1.491637646475	  -2.583131556103
C 	   0.069877591911	  -2.261423973944	  -3.862660877230
Cl	   0.420847632085	  -0.796079178740	  -5.411834463113
C 	  -1.182234471563	  -2.162241655285	  -3.236740401078
C 	  -1.757955365971	  -3.314943623594	  -2.709892488988
C 	  -1.097556586383	  -4.531189291021	  -2.856275849979
C 	   0.107496553219	  -4.646123696454	  -3.542672183756
C 	   0.696890943939	  -3.499862618767	  -4.068633538846
H 	  -1.690183761592	  -1.199956130025	  -3.149933481540
H 	  -2.714461537422	  -3.271554480227	  -2.186043477128
H 	   0.583459066305	  -5.620361190459	  -3.661666687825
H 	   1.636160112707	  -3.565609940312	  -4.620974781766
O 	  -1.710357695729	  -5.676533223387	  -2.331020331739
S 	  -1.130884523261	  -6.372676979053	  -0.998086146716
O 	  -1.837146588888	  -7.617612113822	  -0.875582178862
O 	   0.305224407461	  -6.267314752356	  -0.936550198613
C 	  -1.805134259794	  -5.229792656618	   0.314975319483
F 	  -1.149752676082	  -4.085670074640	   0.295039267121
F 	  -3.087697923324	  -5.012708659925	   0.105748869385
F 	  -1.637289278102	  -5.815900373370	   1.483455987083
24
TS_CCl-PdL1 (VL_PAr3, r0 = 1.7, θ = 150), G = -3500.698294659008
Pd	   1.330176558523	  -0.927513834689	  -3.120923157271
P 	   2.815186367593	   0.378186647845	  -1.778352969061
Cl	   3.786102910987	  -0.669364645870	  -0.750511512021
Cl	   1.943078375400	   1.440115504421	  -0.679490415330
Cl	   3.960274958617	   1.401760159755	  -2.635610512289
C 	   0.068109732682	  -2.253152597417	  -3.851040584531
Cl	   0.404538918808	  -0.787949385283	  -5.395479476228
C 	  -1.180106219928	  -2.157438045245	  -3.216249249601
C 	  -1.753665240824	  -3.312775056799	  -2.692901300084
C 	  -1.095245871409	  -4.528712957802	  -2.850463272340
C 	   0.107213763598	  -4.639844651875	  -3.542030484263
C 	   0.694246721116	  -3.490998794457	  -4.064853044699
H 	  -1.687856380615	  -1.195707202278	  -3.122185884488
H 	  -2.707875519884	  -3.271871228770	  -2.164612176534
H 	   0.582274287845	  -5.613598078527	  -3.668731758048
H 	   1.630394635798	  -3.554322099278	  -4.622763967831
O 	  -1.708527790297	  -5.677817950286	  -2.334225791930
S 	  -1.130556289098	  -6.386297745713	  -1.007321201271
O 	  -1.829011595878	  -7.637301549318	  -0.902986693765
O 	   0.304508959338	  -6.271954333282	  -0.937869177140
C 	  -1.819261928181	  -5.263052104023	   0.314874939342
F 	  -1.170653914714	  -4.114909505378	   0.311490857452
F 	  -3.101758237784	  -5.050986410791	   0.100138086682
F 	  -1.655090794560	  -5.861208304327	   1.477705938132
24
TS_CCl-PdL1 (VL_PAr3, r0 = 1.7, θ = 160), G = -3500.698665623065
Pd	   1.336118949802	  -0.921652655299	  -3.123914800855
P 	   2.833545482462	   0.386627581541	  -1.795584216050
Cl	   3.891091079461	  -0.660392427424	  -0.856507330650
Cl	   1.971847329848	   1.368894569058	  -0.617304002075
Cl	   3.896660675573	   1.489069038118	  -2.660679824771
C 	   0.073597106210	  -2.251380307343	  -3.847492583337
Cl	   0.403670198963	  -0.793511947592	  -5.397077496049
C 	  -1.174941778036	  -2.157078101675	  -3.212847168778
C 	  -1.746997798943	  -3.312557025038	  -2.688134175235
C 	  -1.086799874825	  -4.527855955215	  -2.843597781519
C 	   0.117286080617	  -4.637673055062	  -3.532469841512
C 	   0.702521672916	  -3.488737755109	  -4.057172996832
H 	  -1.684998603805	  -1.196324107728	  -3.121451920908
H 	  -2.702042003863	  -3.272457223695	  -2.161244674388
H 	   0.594172279836	  -5.610812364181	  -3.657324168200
H 	   1.638798649247	  -3.551832779035	  -4.614912148011
O 	  -1.700774616465	  -5.678352462848	  -2.331384733795
S 	  -1.133676180334	  -6.385146149066	  -0.998971047059
O 	  -1.818172457050	  -7.645002678911	  -0.909316377923
O 	   0.298725050652	  -6.253452924072	  -0.907893028125
C 	  -1.857141759534	  -5.275188140835	   0.315584640062
F 	  -1.222161025702	  -4.119495511712	   0.326403453462
F 	  -3.138189506460	  -5.077201823185	   0.079770447279
F 	  -1.705642543414	  -5.875199963084	   1.479128968183
24
TS_CCl-PdL1 (VL_PAr3, r0 = 1.7, θ = 170), G = -3500.699158592573
Pd	   1.365519351993	  -0.911633235656	  -3.115459889172
P 	   2.888720656727	   0.432329387253	  -1.853275833068
Cl	   3.981634271245	  -0.571878704672	  -0.907973759638
Cl	   2.051447676502	   1.449530831089	  -0.687107022707
Cl	   3.918270126116	   1.511946944968	  -2.785279263089
C 	   0.088467759412	  -2.237272658036	  -3.826776485110
Cl	   0.398140045250	  -0.789243623907	  -5.377243747768
C 	  -1.153207322789	  -2.141789811714	  -3.178047620798
C 	  -1.725685927050	  -3.297318308216	  -2.653946671565
C 	  -1.072822086590	  -4.514748910047	  -2.822065066508
C 	   0.127287688325	  -4.625203293676	  -3.517744448121
C 	   0.712491279667	  -3.476554813196	  -4.042748460122
H 	  -1.660034867410	  -1.179992067937	  -3.079786455196
H 	  -2.677268692780	  -3.256418806702	  -2.120901304502
H 	   0.599576010206	  -5.599595851912	  -3.651061134024
H 	   1.643456049570	  -3.541453710263	  -4.609144398130
O 	  -1.692014243344	  -5.668375552485	  -2.324160850152
S 	  -1.136221491944	  -6.393338359897	  -0.996970304847
O 	  -1.762772688114	  -7.685865104107	  -0.969475339265
O 	   0.284271227227	  -6.197556480710	  -0.852020700402
C 	  -1.958009289957	  -5.363628590085	   0.323915440214
F 	  -1.380614546150	  -4.179543515930	   0.388862269243
F 	  -3.238315447390	  -5.218841561675	   0.049697493593
F 	  -1.815819131578	  -5.990268371889	   1.474320744069
24
TS_CCl-PdL1 (VL_PAr3, r0 = 1.7, θ = 180), G = -3500.699178096762
Pd	   1.379606473082	  -0.903914793768	  -3.091538805698
P 	   2.923499356005	   0.468795485529	  -1.889937947839
Cl	   4.127458727418	  -0.504069046240	  -1.053115224066
Cl	   2.130739843785	   1.423275088687	  -0.642468045491
Cl	   3.831044644800	   1.614758004673	  -2.868530922157
C 	   0.102562080322	  -2.233003966528	  -3.803544782982
Cl	   0.408383755781	  -0.797863873673	  -5.355026963152
C 	  -1.142445527881	  -2.140507273580	  -3.159869740622
C 	  -1.717364489372	  -3.297456939171	  -2.641697614771
C 	  -1.063314907666	  -4.514318830494	  -2.809230584778
C 	   0.142987908218	  -4.621931729467	  -3.494503446972
C 	   0.730168840150	  -3.471988920181	  -4.014126556845
H 	  -1.651832753515	  -1.179773489713	  -3.064544891961
H 	  -2.673124679627	  -3.258653674320	  -2.115965182029
H 	   0.617098780552	  -5.595660557707	  -3.626521557932
H 	   1.663856853563	  -3.535910875556	  -4.576165801812
O 	  -1.688512771561	  -5.670940886045	  -2.326125772140
S 	  -1.152672142162	  -6.403554536939	  -0.995198195426
O 	  -1.759431273533	  -7.705803517701	  -0.996341500250
O 	   0.260732787968	  -6.187276609473	  -0.814774755165
C 	  -2.022116075013	  -5.403302905750	   0.317468415339
F 	  -1.461442012021	  -4.213339901484	   0.413784928191
F 	  -3.296413653706	  -5.269912385889	   0.011147408410
F 	  -1.902973358443	  -6.044358034609	   1.462434733054
24
TS_CCl-PdL1 (VL_PAr3, r0 = 1.7, θ = 190), G = -3500.699120132697
Pd	   1.384899894215	  -0.891132974533	  -3.057450302471
P 	   2.952786568798	   0.508362234880	  -1.917105439551
Cl	   3.987645784981	  -0.407624834350	  -0.827946095230
Cl	   2.170674942662	   1.728036239941	  -0.919078357879
Cl	   4.043089396190	   1.384963376869	  -2.983771372063
C 	   0.095509997552	  -2.212831212799	  -3.769798994252
Cl	   0.374318936922	  -0.770520155484	  -5.305369402689
C 	  -1.143424460713	  -2.131048733130	  -3.111998746694
C 	  -1.714790190188	  -3.295436260136	  -2.607141757772
C 	  -1.063140633086	  -4.510105443575	  -2.799117668855
C 	   0.139166780241	  -4.606802949834	  -3.492827073422
C 	   0.721983528656	  -3.449379872788	  -4.000478437219
H 	  -1.652940460311	  -1.172237358150	  -2.999498860524
H 	  -2.667490678569	  -3.263819330956	  -2.075386454830
H 	   0.612259863399	  -5.578537706337	  -3.642486017979
H 	   1.650044020851	  -3.505668404140	  -4.572557984163
O 	  -1.687899197310	  -5.675231469468	  -2.336113461977
S 	  -1.152601060681	  -6.431977446252	  -1.018693480813
O 	  -1.746212821902	  -7.739957903527	  -1.050966870670
O 	   0.257423527502	  -6.205241591925	  -0.825353802834
C 	  -2.041406751274	  -5.469296814087	   0.308681882756
F 	  -1.493891600937	  -4.275945715599	   0.434092148080
F 	  -3.314663375561	  -5.342512264152	  -0.005040712181
F 	  -1.924845604298	  -6.132767579878	   1.441014456167
24
TS_CCl-PdL1 (VL_PAr3, r0 = 1.7, θ = 200), G = -3500.698719275974
Pd	   1.404655319014	  -0.886918215965	  -3.032861036270
P 	   2.979127371092	   0.546698049429	  -1.944872148977
Cl	   4.052052132862	  -0.323074074673	  -0.854855857251
Cl	   2.205506236164	   1.788912246553	  -0.968320046333
Cl	   4.032031148546	   1.403432308812	  -3.064172802680
C 	   0.109978006163	  -2.208647283044	  -3.743643904022
Cl	   0.383049241552	  -0.776056151382	  -5.278343045642
C 	  -1.128488342874	  -2.125952548817	  -3.084123260182
C 	  -1.705961058509	  -3.290416844371	  -2.586617147651
C 	  -1.061078365356	  -4.507364922086	  -2.786787716603
C 	   0.143050389732	  -4.605027694648	  -3.477201502548
C 	   0.731844582749	  -3.447442017188	  -3.977304890393
H 	  -1.635330176346	  -1.166118084318	  -2.968442948460
H 	  -2.659496813411	  -3.257098830946	  -2.056448558711
H 	   0.611673783768	  -5.578065657192	  -3.632489714948
H 	   1.659266690530	  -3.505589893183	  -4.550173478999
O 	  -1.696640599389	  -5.673179934999	  -2.340402591519
S 	  -1.175005649257	  -6.452043429463	  -1.030642432201
O 	  -1.769150453751	  -7.758960491937	  -1.089262650096
O 	   0.233176287843	  -6.229475016353	  -0.819951419141
C 	  -2.077120488866	  -5.509393257786	   0.301462658595
F 	  -1.538368310876	  -4.313704785165	   0.441874858404
F 	  -3.349316826071	  -5.387879604344	  -0.018637735480
F 	  -1.962957698154	  -6.183348036339	   1.427824564049
24
TS_CCl-PdL1 (VL_PAr3, r0 = 1.7, θ = 210), G = -3500.697741775374
Pd	   1.432227647547	  -0.883406888845	  -3.003401298231
P 	   3.010115746411	   0.598134381391	  -1.980523145590
Cl	   4.241132461452	  -0.234842360251	  -1.039167753175
Cl	   2.256871056839	   1.747935908309	  -0.882462263937
Cl	   3.888117060917	   1.567364848219	  -3.157632002590
C 	   0.137348826267	  -2.211444240482	  -3.712705731290
Cl	   0.408463141231	  -0.800831082936	  -5.251659166969
C 	  -1.106736654511	  -2.127065616987	  -3.062683954785
C 	  -1.693417191214	  -3.290119762628	  -2.573408392007
C 	  -1.052088993894	  -4.509433709389	  -2.770797319764
C 	   0.161509206512	  -4.609272967588	  -3.444033764030
C 	   0.759275719450	  -3.452847121371	  -3.936017393562
H 	  -1.613788170394	  -1.166643143864	  -2.953536422572
H 	  -2.653137440454	  -3.254348972781	  -2.054729334961
H 	   0.628884962268	  -5.583462420028	  -3.595950655155
H 	   1.691406486106	  -3.514522360771	  -4.500750896676
O 	  -1.703762549942	  -5.674586448646	  -2.346152810048
S 	  -1.212098793539	  -6.473935296579	  -1.037697363651
O 	  -1.812131182989	  -7.776691964838	  -1.124757944131
O 	   0.192946318088	  -6.262238891398	  -0.797114190746
C 	  -2.135019440622	  -5.542640874541	   0.287368961384
F 	  -1.603306505644	  -4.345298944646	   0.440347659187
F 	  -3.403448859148	  -5.424923406853	  -0.048814356132
F 	  -2.032866443626	  -6.221592831897	   1.411886732400
24
TS_CCl-PdL1 (VL_PAr3, r0 = 1.8, θ = 120), G = -3500.799325388724
Pd	   1.362458308093	  -0.942231725007	  -3.075845293456
P 	   2.844595596836	   0.429066583507	  -1.850650462178
Cl	   4.039618458117	  -0.533472040611	  -0.841871707638
Cl	   1.982333131725	   1.496871908220	  -0.630794276623
Cl	   3.894325959296	   1.589123747106	  -2.811403885067
C 	   0.092927512556	  -2.264300125025	  -3.802757207945
Cl	   0.445426554887	  -0.784475195847	  -5.347926128838
C 	  -1.158071952311	  -2.162110902667	  -3.176559199396
C 	  -1.746998861801	  -3.318116548285	  -2.672368501230
C 	  -1.098547238810	  -4.538199593183	  -2.839479358128
C 	   0.110372329694	  -4.652540543797	  -3.519036335914
C 	   0.712760453317	  -3.503153833938	  -4.023035589051
H 	  -1.657626951511	  -1.196734950387	  -3.076236360202
H 	  -2.705813822585	  -3.274580464695	  -2.152877489182
H 	   0.577745793325	  -5.629008548441	  -3.652963148392
H 	   1.653436238410	  -3.568274621343	  -4.573078678285
O 	  -1.728911745491	  -5.687778511164	  -2.347581784036
S 	  -1.176613912318	  -6.419955105171	  -1.021874867113
O 	  -1.880179723800	  -7.670288351990	  -0.951183229935
O 	   0.257240736083	  -6.310318177226	  -0.925462482500
C 	  -1.887181398240	  -5.314158088004	   0.303498033903
F 	  -1.234647983104	  -4.168368525450	   0.328684259522
F 	  -3.164308569758	  -5.094472540414	   0.065967066851
F 	  -1.747842505465	  -5.929238015591	   1.460443817754
24
TS_CCl-PdL1 (VL_PAr3, r0 = 1.8, θ = 130), G = -3500.799625928074
Pd	   1.345026600957	  -0.942312164113	  -3.106125239847
P 	   2.814410367281	   0.393595657367	  -1.822573617035
Cl	   3.953807116064	  -0.622043615927	  -0.801372016938
Cl	   1.929690893828	   1.439820692774	  -0.600111558153
Cl	   3.918385542392	   1.560256580213	  -2.711522332426
C 	   0.080873315980	  -2.268551597002	  -3.828179545632
Cl	   0.439410772384	  -0.784635111893	  -5.380539444257
C 	  -1.170648497464	  -2.164646959502	  -3.204059582704
C 	  -1.756072035450	  -3.318787782777	  -2.691206357972
C 	  -1.103788642760	  -4.537977488005	  -2.849180469102
C 	   0.103129225537	  -4.654486474389	  -3.531955432722
C 	   0.702306101307	  -3.506941866182	  -4.044167736519
H 	  -1.671895993541	  -1.199640126934	  -3.108948043479
H 	  -2.714153059924	  -3.274249421686	  -2.170421854946
H 	   0.572555670354	  -5.630726786319	  -3.659972661447
H 	   1.642839577881	  -3.573172418093	  -4.594280734109
O 	  -1.727214213511	  -5.684164323763	  -2.340682251698
S 	  -1.159023286584	  -6.401801911325	  -1.013546817743
O 	  -1.870132518437	  -7.645891325506	  -0.914430371996
O 	   0.276883031145	  -6.301393722842	  -0.941423296190
C 	  -1.839158825079	  -5.273557163857	   0.309111069556
F 	  -1.178587913520	  -4.132179541728	   0.308264776801
F 	  -3.118861101406	  -5.048216163608	   0.091778560717
F 	  -1.683285720290	  -5.875011134299	   1.471152150776
24
TS_CCl-PdL1 (VL_PAr3, r0 = 1.8, θ = 140), G = -3500.799987093327
Pd	   1.336369457586	  -0.937705869158	  -3.125762089009
P 	   2.802195496602	   0.376206753699	  -1.814169950161
Cl	   3.910875159562	  -0.672854452305	  -0.792804190365
Cl	   1.909562838286	   1.409271635506	  -0.586266733015
Cl	   3.935543562086	   1.544846090236	  -2.662484279905
C 	   0.074499042073	  -2.268156859669	  -3.841285179383
Cl	   0.431087610453	  -0.783528071965	  -5.399270179110
C 	  -1.176236985630	  -2.164537861055	  -3.215876937370
C 	  -1.757913764658	  -3.318146600897	  -2.697333336848
C 	  -1.102892093583	  -4.536324057571	  -2.851587619367
C 	   0.102333172550	  -4.652791138300	  -3.537363748578
C 	   0.697828867952	  -3.505789777596	  -4.055196175373
H 	  -1.679312343609	  -1.200270910262	  -3.123019251814
H 	  -2.714861994656	  -3.273894998543	  -2.174408996730
H 	   0.573626741646	  -5.628466245879	  -3.662816880173
H 	   1.637448628824	  -3.571906678727	  -4.606871160649
O 	  -1.721619145012	  -5.681690337093	  -2.335549736521
S 	  -1.146922961882	  -6.391490882344	  -1.006919492445
O 	  -1.855064018862	  -7.636519600537	  -0.898818419856
O 	   0.289023065621	  -6.287744202862	  -0.940760906161
C 	  -1.824457723107	  -5.258444855258	   0.312993540169
F 	  -1.166538950550	  -4.115621856408	   0.304240866599
F 	  -3.105497095148	  -5.037028268245	   0.099754449371
F 	  -1.662580159349	  -5.854125124150	   1.477183599618
24
TS_CCl-PdL1 (VL_PAr3, r0 = 1.8, θ = 150), G = -3500.800380440818
Pd	   1.337945208542	  -0.931613939280	  -3.125803788081
P 	   2.811983914108	   0.384840645816	  -1.825553802929
Cl	   3.918964312455	  -0.664365747400	  -0.802444224682
Cl	   1.928828527253	   1.428562307101	  -0.599836417269
Cl	   3.948402910979	   1.543042299021	  -2.683984373124
C 	   0.074647040677	  -2.264024096556	  -3.837224697713
Cl	   0.422972532719	  -0.781997199108	  -5.396172930502
C 	  -1.174974962259	  -2.162766360408	  -3.208942335764
C 	  -1.754479648487	  -3.317530459054	  -2.690524096656
C 	  -1.098516709912	  -4.534932615573	  -2.847167577543
C 	   0.106463363443	  -4.649025832716	  -3.533735063681
C 	   0.699570565092	  -3.500894033605	  -4.051819289894
H 	  -1.679530545243	  -1.199381242817	  -3.114957687147
H 	  -2.710994651269	  -3.274869730150	  -2.166628942199
H 	   0.578893627864	  -5.623989449414	  -3.660649774399
H 	   1.638214854896	  -3.565645701870	  -4.605331990488
O 	  -1.716726380803	  -5.682290690477	  -2.335028755620
S 	  -1.145982148461	  -6.394551644808	  -1.006091635224
O 	  -1.845566360079	  -7.645326027280	  -0.908908942597
O 	   0.288679608477	  -6.280373237143	  -0.929440014652
C 	  -1.841962069478	  -5.272709002461	   0.313594501584
F 	  -1.192525329757	  -4.125004343910	   0.314716646299
F 	  -3.122860778233	  -5.059724562378	   0.091022509915
F 	  -1.684950475382	  -5.872143504922	   1.476519875306
24
TS_CCl-PdL1 (VL_PAr3, r0 = 1.8, θ = 160), G = -3500.800969276956
Pd	   1.358573353753	  -0.923345689061	  -3.117902572204
P 	   2.848508629757	   0.419775007998	  -1.864934651545
Cl	   3.987645195948	  -0.597797020158	  -0.845196341543
Cl	   1.983580409400	   1.482049523607	  -0.642138913995
Cl	   3.955634441150	   1.568940576082	  -2.772458827165
C 	   0.086715802945	  -2.254982342831	  -3.821079948645
Cl	   0.418700556862	  -0.781471085347	  -5.380599611061
C 	  -1.157872706639	  -2.153618106290	  -3.182179056558
C 	  -1.737459011828	  -3.308749569873	  -2.664755622425
C 	  -1.086892967749	  -4.527659770112	  -2.831686456910
C 	   0.115605447390	  -4.641383791475	  -3.522691450667
C 	   0.708542740997	  -3.493025484228	  -4.040243022866
H 	  -1.660465319396	  -1.189733783538	  -3.082754496867
H 	  -2.691192503695	  -3.265349084408	  -2.135894643181
H 	   0.584886755607	  -5.617072206078	  -3.656289795122
H 	   1.643497652681	  -3.558556712298	  -4.599899905608
O 	  -1.709712495291	  -5.678013370321	  -2.332429459727
S 	  -1.151429448364	  -6.404630478720	  -1.006172211198
O 	  -1.818589889259	  -7.675605785985	  -0.952300455303
O 	   0.277260543313	  -6.253207690912	  -0.891801498546
C 	  -1.912430629037	  -5.330940362446	   0.316796610611
F 	  -1.297176916166	  -4.164991772013	   0.354288151748
F 	  -3.192913912237	  -5.150407038100	   0.065561516230
F 	  -1.766519322994	  -5.946938132879	   1.472369855474
24
TS_CCl-PdL1 (VL_PAr3, r0 = 1.8, θ = 170), G = -3500.801195570090
Pd	   1.376390606860	  -0.915296663582	  -3.106000448335
P 	   2.884630033731	   0.449595824358	  -1.901745243426
Cl	   4.071896747759	  -0.538622803180	  -0.908478282175
Cl	   2.044243228154	   1.515212455479	  -0.664802513945
Cl	   3.944914178553	   1.603134846120	  -2.858509715851
C 	   0.097220285926	  -2.245948895095	  -3.803887321526
Cl	   0.418680070103	  -0.780933667881	  -5.363574246825
C 	  -1.145932214336	  -2.145606102632	  -3.161278747960
C 	  -1.726375260555	  -3.301447084436	  -2.646446722263
C 	  -1.077916249213	  -4.520733148731	  -2.818039769031
C 	   0.125108647537	  -4.633435058527	  -3.508222855715
C 	   0.718403242949	  -3.484569882801	  -4.024008983193
H 	  -1.648371568450	  -1.181824904944	  -3.060125622622
H 	  -2.680575759148	  -3.259238821643	  -2.118273905511
H 	   0.593376717827	  -5.609237614737	  -3.645003990692
H 	   1.652023034383	  -3.550311442205	  -4.585896066462
O 	  -1.704697792270	  -5.673375916977	  -2.329518210947
S 	  -1.156702996577	  -6.410670253723	  -1.005077700796
O 	  -1.789503104839	  -7.700163938898	  -0.989195279406
O 	   0.264138880032	  -6.222001177875	  -0.854772581169
C 	  -1.978562174537	  -5.385178587574	   0.319099317947
F 	  -1.396892131785	  -4.203556078017	   0.391102972472
F 	  -3.257394486133	  -5.234397814466	   0.041802207074
F 	  -1.841605528821	  -6.018107437424	   1.466460903290
24
TS_CCl-PdL1 (VL_PAr3, r0 = 1.8, θ = 180), G = -3500.801235032565
Pd	   1.381746451270	  -0.903705721162	  -3.084199328519
P 	   2.909724359318	   0.478227081115	  -1.925400830435
Cl	   4.040218139476	  -0.478334246220	  -0.839308694543
Cl	   2.096062703642	   1.669832441016	  -0.789771881532
Cl	   4.032683429623	   1.510099252251	  -2.947617734124
C 	   0.096620153946	  -2.232853514932	  -3.781268145796
Cl	   0.401087826169	  -0.767533074589	  -5.333513760764
C 	  -1.144196903274	  -2.139388392303	  -3.132371458357
C 	  -1.722452948581	  -3.299606738335	  -2.625091907835
C 	  -1.074028419055	  -4.517193434613	  -2.808624125350
C 	   0.128374198269	  -4.622982502596	  -3.500880162373
C 	   0.718846747322	  -3.469797301362	  -4.010068400741
H 	  -1.648110928271	  -1.177217743551	  -3.023552147785
H 	  -2.676184570872	  -3.262247170701	  -2.095661584706
H 	   0.597336045531	  -5.597299457312	  -3.646030300036
H 	   1.650118130736	  -3.531053109784	  -4.576342832244
O 	  -1.700953831877	  -5.675368084228	  -2.333555295024
S 	  -1.157645062529	  -6.425861932952	  -1.014771524196
O 	  -1.771227186490	  -7.724717346458	  -1.025640079503
O 	   0.258256856575	  -6.218080723307	  -0.844675855857
C 	  -2.011712141848	  -5.434548230498	   0.314721967176
F 	  -1.447099559943	  -4.246622363826	   0.414153685685
F 	  -3.288456144628	  -5.295989091175	   0.021720262583
F 	  -1.882510937363	  -6.084472763874	   1.453357327211
24
TS_CCl-PdL1 (VL_PAr3, r0 = 1.8, θ = 190), G = -3500.801105540786
Pd	   1.394882107302	  -0.897418685890	  -3.061629306191
P 	   2.936681588924	   0.509731135090	  -1.949857687940
Cl	   4.130700476471	  -0.414018182268	  -0.904281214475
Cl	   2.147978100462	   1.699217905629	  -0.794553534298
Cl	   3.995348546825	   1.553168409783	  -3.027741237430
C 	   0.107716521706	  -2.228377341104	  -3.758551599634
Cl	   0.405820391568	  -0.771628049081	  -5.309747245424
C 	  -1.134822290232	  -2.137596133294	  -3.111762914404
C 	  -1.715754615475	  -3.299316809411	  -2.611206107243
C 	  -1.068211007054	  -4.516889666120	  -2.798125457111
C 	   0.138046190369	  -4.620166540953	  -3.483948708503
C 	   0.730777927888	  -3.465455559486	  -3.986876330115
H 	  -1.639836506313	  -1.176064886929	  -3.002590025837
H 	  -2.672045796287	  -3.263129026727	  -2.086305334920
H 	   0.607079233171	  -5.594185723970	  -3.631120664985
H 	   1.663114457844	  -3.525930840910	  -4.551460649027
O 	  -1.700988389116	  -5.677679505625	  -2.337308616736
S 	  -1.172815024706	  -6.439326772088	  -1.018956994525
O 	  -1.775938453921	  -7.742723649565	  -1.053201690640
O 	   0.238522086855	  -6.222398108034	  -0.824356299381
C 	  -2.056317218237	  -5.469593540622	   0.306823786854
F 	  -1.503800583997	  -4.277979180494	   0.427320363198
F 	  -3.329305603860	  -5.338881674864	  -0.005708478449
F 	  -1.940335733037	  -6.130071742456	   1.440753140135
24
TS_CCl-PdL1 (VL_PAr3, r0 = 1.8, θ = 200), G = -3500.800775275051
Pd	   1.411797292912	  -0.891420452030	  -3.032710255001
P 	   2.966165150890	   0.548372581637	  -1.976103746334
Cl	   4.236350630695	  -0.329827670305	  -0.982455736792
Cl	   2.204107360275	   1.732259349129	  -0.797407853691
Cl	   3.940488039527	   1.606589730642	  -3.117360823347
C 	   0.123040126890	  -2.224696433771	  -3.730760843502
Cl	   0.417278338804	  -0.780880586749	  -5.281557381063
C 	  -1.122377618208	  -2.135493435836	  -3.088288622581
C 	  -1.708258609951	  -3.298061726976	  -2.595868951216
C 	  -1.062953733319	  -4.516426503395	  -2.785563952674
C 	   0.148843772057	  -4.618400620566	  -3.461673272619
C 	   0.746306294212	  -3.462713773446	  -3.956523934439
H 	  -1.627943819171	  -1.174189178197	  -2.980007142798
H 	  -2.667937720532	  -3.261986188339	  -2.077195452336
H 	   0.617235242717	  -5.592556642784	  -3.610170174668
H 	   1.680785172397	  -3.523540116476	  -4.517464804432
O 	  -1.705475780301	  -5.678946698436	  -2.342747392789
S 	  -1.196197383752	  -6.458407657390	  -1.027685190984
O 	  -1.796276893064	  -7.762337204982	  -1.088541601043
O 	   0.211597065527	  -6.241756859491	  -0.808770575281
C 	  -2.102239114643	  -5.507837502314	   0.296123532659
F 	  -1.561686309706	  -4.312384734295	   0.432065654648
F 	  -3.372768885256	  -5.385802721343	  -0.029807091837
F 	  -1.993382211854	  -6.176269123692	   1.426082805041
24
TS_CCl-PdL1 (VL_PAr3, r0 = 1.8, θ = 210), G = -3500.800038646819
Pd	   1.430593074998	  -0.883269012885	  -3.005777659992
P 	   2.992451531602	   0.590792133700	  -2.002363118401
Cl	   4.320893828440	  -0.244906299637	  -1.049218837913
Cl	   2.254254714633	   1.781340971227	  -0.815285123398
Cl	   3.896636379560	   1.649307391985	  -3.199759970007
C 	   0.140416801335	  -2.221239484553	  -3.702177127919
Cl	   0.429389300940	  -0.792990079192	  -5.254553694634
C 	  -1.107241802614	  -2.132190325567	  -3.062911307227
C 	  -1.699293794825	  -3.294806403224	  -2.578348507306
C 	  -1.058264020357	  -4.514822582255	  -2.771757189289
C 	   0.158489036592	  -4.617045176405	  -3.438849660472
C 	   0.761971130463	  -3.461133206822	  -3.925590067566
H 	  -1.612383463145	  -1.170621583131	  -2.955487873466
H 	  -2.662045463631	  -3.257762976769	  -2.065494189934
H 	   0.624688103331	  -5.591928103806	  -3.589558705966
H 	   1.697975005168	  -3.523691266158	  -4.483669736387
O 	  -1.712704668589	  -5.677891255858	  -2.347970931906
S 	  -1.222253620122	  -6.480038977395	  -1.039808649743
O 	  -1.824608974486	  -7.781430549045	  -1.128681825116
O 	   0.183142788731	  -6.270548268350	  -0.799682295135
C 	  -2.143359913704	  -5.547310486077	   0.285502313388
F 	  -1.612753391018	  -4.348814637032	   0.433643967110
F 	  -3.412634418211	  -5.432382654716	  -0.047769405138
F 	  -2.036861757943	  -6.223331337435	   1.411176789354
24
TS_CCl-PdL1 (VL_PAr3, r0 = 1.9, θ = 120), G = -3500.858008870281
Pd	   1.387563451200	  -0.937634238505	  -3.069239961402
P 	   2.867057457305	   0.464498496748	  -1.923882250554
Cl	   4.248783749144	  -0.459369577139	  -0.965179996096
Cl	   2.031967203324	   1.518504241290	  -0.555230428662
Cl	   3.847461312541	   1.769186577242	  -2.932365449188
C 	   0.113828783430	  -2.271228849984	  -3.770677997177
Cl	   0.471334319767	  -0.782700951538	  -5.332673462408
C 	  -1.137910761001	  -2.163004558813	  -3.149729984653
C 	  -1.735298348652	  -3.318540473987	  -2.654302542935
C 	  -1.092241639614	  -4.541017563178	  -2.824379940260
C 	   0.120926354140	  -4.658264901934	  -3.495755789372
C 	   0.731700759199	  -3.509612023427	  -3.991657704437
H 	  -1.633264375459	  -1.195631187193	  -3.048134344701
H 	  -2.697189835712	  -3.272876242525	  -2.140893481730
H 	   0.584144743347	  -5.636322289263	  -3.632485883297
H 	   1.674951861296	  -3.576733994165	  -4.537007994458
O 	  -1.733792067368	  -5.690380656312	  -2.349356574375
S 	  -1.203750526588	  -6.438450516400	  -1.022686341309
O 	  -1.888591761626	  -7.700564638630	  -0.992351926868
O 	   0.225063444097	  -6.307007001107	  -0.887635801421
C 	  -1.968585829761	  -5.367019686757	   0.300171375956
F 	  -1.340143083068	  -4.208741383721	   0.354894269544
F 	  -3.243484552668	  -5.169471430717	   0.034294188113
F 	  -1.844034250130	  -5.994331319374	   1.451875214630
24
TS_CCl-PdL1 (VL_PAr3, r0 = 1.9, θ = 130), G = -3500.858282355154
Pd	   1.377696960579	  -0.934939321037	  -3.087517964130
P 	   2.855269493610	   0.449508480473	  -1.917278906702
Cl	   4.203633015718	  -0.510068411909	  -0.946101598515
Cl	   2.007838946680	   1.490525697668	  -0.546193629878
Cl	   3.873946831073	   1.756649415738	  -2.883629237709
C 	   0.106199392273	  -2.271560538236	  -3.783840806478
Cl	   0.462292500432	  -0.780958090053	  -5.350335218371
C 	  -1.144572446123	  -2.163576539012	  -3.161251393696
C 	  -1.738383645696	  -3.318760675164	  -2.660518310060
C 	  -1.092951863317	  -4.540397245929	  -2.827708134885
C 	   0.118414915951	  -4.657502767175	  -3.502385781283
C 	   0.725766375970	  -3.509187412681	  -4.003371376515
H 	  -1.641393248752	  -1.196793776484	  -3.061208641214
H 	  -2.698906316496	  -3.273204585744	  -2.144508798359
H 	   0.583283384008	  -5.635075109582	  -3.636982209966
H 	   1.668158850895	  -3.576017415082	  -4.550242140991
O 	  -1.729777903398	  -5.689185744934	  -2.345004554790
S 	  -1.192479403499	  -6.429433009241	  -1.016754736854
O 	  -1.876990980291	  -7.691418730084	  -0.975512124634
O 	   0.237046207406	  -6.297091360806	  -0.890257646411
C 	  -1.950140974114	  -5.350411652503	   0.304207416278
F 	  -1.320229565903	  -4.192600117160	   0.350614297971
F 	  -3.226027732086	  -5.152895238464	   0.042998455496
F 	  -1.821196387768	  -5.972320021999	   1.458390234632
24
TS_CCl-PdL1 (VL_PAr3, r0 = 1.9, θ = 140), G = -3500.858864386249
Pd	   1.365228167605	  -0.933334545195	  -3.104743380867
P 	   2.839292712164	   0.431382629055	  -1.905009609839
Cl	   4.159499976386	  -0.565738015527	  -0.932880510002
Cl	   1.980555449438	   1.448894402423	  -0.523359868048
Cl	   3.888643127302	   1.748388097394	  -2.823760670295
C 	   0.097852324607	  -2.273640803703	  -3.797881392148
Cl	   0.455732150624	  -0.780662318855	  -5.368865168715
C 	  -1.153286664045	  -2.166196758107	  -3.176303949646
C 	  -1.743811170291	  -3.321083817858	  -2.670764750652
C 	  -1.094942851783	  -4.541565995094	  -2.833091996471
C 	   0.115640478721	  -4.658378022008	  -3.509235076162
C 	   0.719863465507	  -3.510329590166	  -4.014745136545
H 	  -1.652219041552	  -1.200215835780	  -3.079156748750
H 	  -2.703881381818	  -3.276022664909	  -2.153830005556
H 	   0.582823348767	  -5.635291811562	  -3.640438625428
H 	   1.662275825996	  -3.576698841128	  -4.561625465508
O 	  -1.726885821464	  -5.689410724697	  -2.341741759935
S 	  -1.182341894986	  -6.419809768402	  -1.010871576405
O 	  -1.872590202418	  -7.677998898621	  -0.952577200124
O 	   0.248824325361	  -6.293444888454	  -0.897318560523
C 	  -1.923458559518	  -5.324828803209	   0.306637490923
F 	  -1.284920286600	  -4.171368285307	   0.340602911764
F 	  -3.199621701117	  -5.120092513669	   0.052038130008
F 	  -1.791775369747	  -5.939266395970	   1.464530111850
24
TS_CCl-PdL1 (VL_PAr3, r0 = 1.9, θ = 150), G = -3500.859163144341
Pd	   1.365932944425	  -0.927947558424	  -3.113697358264
P 	   2.844544552802	   0.432238774465	  -1.913153998764
Cl	   4.161690927911	  -0.576711246674	  -0.949041731681
Cl	   1.989444921354	   1.440816963438	  -0.522711694769
Cl	   3.897847657103	   1.752950435627	  -2.821925403976
C 	   0.097833070377	  -2.270554017524	  -3.801008784551
Cl	   0.451249148235	  -0.779916151761	  -5.375839880812
C 	  -1.151855092848	  -2.163063768133	  -3.176498377501
C 	  -1.740424206947	  -3.317543767416	  -2.667599530688
C 	  -1.091305185606	  -4.537898547044	  -2.829612552610
C 	   0.117897705901	  -4.654840167448	  -3.508232327712
C 	   0.720164276280	  -3.507242882038	  -4.017119692527
H 	  -1.651452858748	  -1.197372995824	  -3.079886720288
H 	  -2.699367951889	  -3.272221634755	  -2.148576816328
H 	   0.585391084969	  -5.631660751968	  -3.639242608596
H 	   1.661296575537	  -3.574038207396	  -4.566152169630
O 	  -1.721947486631	  -5.685907181658	  -2.337104406041
S 	  -1.176899075721	  -6.415965580446	  -1.006257782154
O 	  -1.853694050405	  -7.681821053975	  -0.956531423130
O 	   0.252113033460	  -6.274326865183	  -0.884064233505
C 	  -1.938140547748	  -5.334706453126	   0.310809544928
F 	  -1.314112944747	  -4.173481949623	   0.350761267094
F 	  -3.215426282133	  -5.144895834325	   0.050644378232
F 	  -1.804283807762	  -5.950603728209	   1.467649496198
24
TS_CCl-PdL1 (VL_PAr3, r0 = 1.9, θ = 160), G = -3500.859532846090
Pd	   1.371950849697	  -0.920126725675	  -3.114439179085
P 	   2.860636353633	   0.444491045683	  -1.930983722599
Cl	   4.186681913398	  -0.561548723158	  -0.976037379383
Cl	   2.020208027112	   1.459716091502	  -0.536445021258
Cl	   3.906028327522	   1.760094083214	  -2.856170382319
C 	   0.101330257680	  -2.264420270003	  -3.796449850025
Cl	   0.448289179285	  -0.778964440484	  -5.373866849527
C 	  -1.147333653158	  -2.157591996774	  -3.169448200065
C 	  -1.734795822407	  -3.312147218784	  -2.659332063169
C 	  -1.085746054442	  -4.532347445310	  -2.822111681629
C 	   0.123076190844	  -4.648777994520	  -3.501490103959
C 	   0.724067465207	  -3.501202909962	  -4.011869800679
H 	  -1.647732208272	  -1.192292441652	  -3.073114954408
H 	  -2.693542301174	  -3.267504342914	  -2.139848676546
H 	   0.590799645987	  -5.625433210511	  -3.633205954509
H 	   1.664141386771	  -3.568219401042	  -4.562696301769
O 	  -1.717009197303	  -5.681299522432	  -2.332811543003
S 	  -1.174553994208	  -6.416170293195	  -1.003643705106
O 	  -1.828600066823	  -7.694586728290	  -0.974796115911
O 	   0.249985456244	  -6.249623825274	  -0.862621503983
C 	  -1.972028802888	  -5.363899030142	   0.314918649532
F 	  -1.372675154762	  -4.190287736144	   0.370354985662
F 	  -3.250250519426	  -5.197893679903	   0.043910110625
F 	  -1.836430871385	  -5.986677453634	   1.467806436071
24
TS_CCl-PdL1 (VL_PAr3, r0 = 1.9, θ = 170), G = -3500.859808467867
Pd	   1.382821542849	  -0.916092915964	  -3.103873359087
P 	   2.879459333652	   0.463993428446	  -1.947891737675
Cl	   4.225276094909	  -0.518133069769	  -0.995757805748
Cl	   2.053974136256	   1.500055206199	  -0.559802708968
Cl	   3.904323002865	   1.767972986748	  -2.911783068451
C 	   0.108004926363	  -2.259753550969	  -3.784288039966
Cl	   0.449071543776	  -0.779449250331	  -5.360511457668
C 	  -1.140143158291	  -2.153726693334	  -3.155535912607
C 	  -1.728927484824	  -3.308871354073	  -2.648274119108
C 	  -1.081666576971	  -4.529469388322	  -2.814755434927
C 	   0.127679544428	  -4.645184151904	  -3.493263235293
C 	   0.729657480325	  -3.497099360607	  -4.001214545392
H 	  -1.640252466507	  -1.188438225432	  -3.057675473052
H 	  -2.688210999861	  -3.264894107702	  -2.129645451290
H 	   0.594366555801	  -5.622018961809	  -3.627568407744
H 	   1.668993028027	  -3.564303424389	  -4.553270416259
O 	  -1.716135234510	  -5.679834591257	  -2.333089357919
S 	  -1.180147304926	  -6.423036215186	  -1.006120765187
O 	  -1.819751416568	  -7.709113043993	  -0.997419072381
O 	   0.240677751574	  -6.241459357747	  -0.847340656547
C 	  -2.005179775787	  -5.394792555162	   0.314127487086
F 	  -1.420038464812	  -4.214903388138	   0.388028012182
F 	  -3.282108208824	  -5.240241144953	   0.030571308725
F 	  -1.875247441809	  -6.027921039758	   1.461961410208
24
TS_CCl-PdL1 (VL_PAr3, r0 = 1.9, θ = 180), G = -3500.859958878221
Pd	   1.395831089329	  -0.912501042253	  -3.086494048851
P 	   2.900364515674	   0.489000024243	  -1.964980962899
Cl	   4.284056852741	  -0.457839410872	  -1.031674576625
Cl	   2.097593296381	   1.541848726228	  -0.576243533300
Cl	   3.882712516147	   1.787340907161	  -2.979592675251
C 	   0.117916868363	  -2.256103712277	  -3.767369843050
Cl	   0.455274418645	  -0.782917624439	  -5.342245568101
C 	  -1.130785861363	  -2.150570639896	  -3.138925747483
C 	  -1.722649981405	  -3.306167460838	  -2.636319665231
C 	  -1.077920275121	  -4.527589508964	  -2.806382177203
C 	   0.133323307396	  -4.642904382737	  -3.481545355561
C 	   0.738098151964	  -3.494398157588	  -3.985045758721
H 	  -1.630386562829	  -1.185120815488	  -3.040128357157
H 	  -2.683358304905	  -3.262084884942	  -2.120286589823
H 	   0.598526696418	  -5.620140973177	  -3.618326513162
H 	   1.677567304819	  -3.562204254488	  -4.536791119649
O 	  -1.717770966616	  -5.679277886857	  -2.335077111323
S 	  -1.191506580620	  -6.433627090044	  -1.010690511881
O 	  -1.820461496682	  -7.724891317271	  -1.023450174203
O 	   0.225653216855	  -6.241953433992	  -0.832788416104
C 	  -2.041558514887	  -5.427808150833	   0.310409864161
F 	  -1.469184765031	  -4.242943157927	   0.402189633048
F 	  -3.316650532854	  -5.283022639409	   0.013971367517
F 	  -1.918187985271	  -6.070837282752	   1.453395033783
24
TS_CCl-PdL1 (VL_PAr3, r0 = 1.9, θ = 190), G = -3500.859696532862
Pd	   1.388105066406	  -0.891500421895	  -3.058261430505
P 	   2.924142240280	   0.515215098383	  -1.982776552875
Cl	   4.145563684242	  -0.410165652609	  -0.827873086910
Cl	   2.149339978246	   1.828847778331	  -0.818686464997
Cl	   4.094264462884	   1.556492993691	  -3.090503730034
C 	   0.103483952979	  -2.233004376946	  -3.738754258581
Cl	   0.411997240584	  -0.749714732438	  -5.299685095586
C 	  -1.140510858062	  -2.141584693465	  -3.098193948798
C 	  -1.724593452533	  -3.305931144304	  -2.606899495662
C 	  -1.076892953310	  -4.522743948992	  -2.797984748720
C 	   0.130901264987	  -4.623864594359	  -3.481370904627
C 	   0.727028644479	  -3.466610598767	  -3.974908431633
H 	  -1.643898753472	  -1.179799299730	  -2.984145927508
H 	  -2.682649313150	  -3.271863260922	  -2.085170366627
H 	   0.599192771853	  -5.597437979792	  -3.633404751103
H 	   1.661690390436	  -3.524141679177	  -4.535861216518
O 	  -1.710476351410	  -5.684307557580	  -2.342588250459
S 	  -1.180454639623	  -6.454324271189	  -1.028802759901
O 	  -1.786506497609	  -7.756032721738	  -1.068749006439
O 	   0.231775193605	  -6.240786786429	  -0.837443790481
C 	  -2.058762294237	  -5.488232452362	   0.303188451508
F 	  -1.505343769730	  -4.297038413596	   0.424105715410
F 	  -3.332715381456	  -5.356648458639	  -0.004379185767
F 	  -1.938184219235	  -6.151536994871	   1.434756429755
24
TS_CCl-PdL1 (VL_PAr3, r0 = 1.9, θ = 200), G = -3500.859331164888
Pd	   1.402884389820	  -0.885706416643	  -3.035164504726
P 	   2.950717246745	   0.544539831742	  -2.001505650516
Cl	   4.227749355293	  -0.338604904909	  -0.874197339329
Cl	   2.194627468720	   1.870995113787	  -0.839697070612
Cl	   4.063652522093	   1.583001938895	  -3.169415690562
C 	   0.115318355297	  -2.228180923348	  -3.715376099874
Cl	   0.419165042611	  -0.753585880620	  -5.275703888652
C 	  -1.130370734880	  -2.138193439661	  -3.077153634396
C 	  -1.718323296831	  -3.303333094023	  -2.592618763369
C 	  -1.073022217071	  -4.520851442284	  -2.787356877414
C 	   0.138270953002	  -4.620826762741	  -3.464601921345
C 	   0.738002311977	  -3.462643942550	  -3.951521857421
H 	  -1.633887382346	  -1.176572182895	  -2.962655762132
H 	  -2.678577706314	  -3.269305211247	  -2.074972480354
H 	   0.605529900801	  -5.594544581135	  -3.619080629668
H 	   1.673548999732	  -3.520528093374	  -4.510888707219
O 	  -1.714119674384	  -5.683907238956	  -2.346318400144
S 	  -1.197760079391	  -6.469424753431	  -1.036458094055
O 	  -1.796827925480	  -7.773477108353	  -1.100879424820
O 	   0.210775545075	  -6.251663712404	  -0.823906301798
C 	  -2.098628572937	  -5.524725087083	   0.295171930872
F 	  -1.561120214318	  -4.327671339102	   0.429367587277
F 	  -3.371468905091	  -5.406699780582	  -0.022380171719
F 	  -1.979638974970	  -6.194805158479	   1.422920944913
24
TS_CCl-PdL1 (VL_PAr3, r0 = 1.9, θ = 210), G = -3500.858957732145
Pd	   1.435945842261	  -0.887636923909	  -3.009143464171
P 	   2.972627393042	   0.592548175951	  -2.026264698965
Cl	   4.456431292495	  -0.238781077215	  -1.138340473955
Cl	   2.257457058671	   1.758503490623	  -0.680889605719
Cl	   3.832712158064	   1.812407465102	  -3.231973450049
C 	   0.153369190224	  -2.239739065805	  -3.690142648929
Cl	   0.471780004278	  -0.796404046278	  -5.262198994656
C 	  -1.100004318170	  -2.140771560837	  -3.067359183847
C 	  -1.702733474333	  -3.300329847781	  -2.587762823393
C 	  -1.064763969137	  -4.523175177484	  -2.772413494081
C 	   0.157327941810	  -4.632612162896	  -3.428624017232
C 	   0.772060889969	  -3.479884242867	  -3.909323462262
H 	  -1.600964749517	  -1.176456890075	  -2.965550251980
H 	  -2.670443993580	  -3.258213412556	  -2.084836724312
H 	   0.619840017109	  -5.609801527799	  -3.575124064190
H 	   1.714038239971	  -3.546907183620	  -4.456610645636
O 	  -1.727105192752	  -5.681206391181	  -2.349704831354
S 	  -1.243492220678	  -6.487413804944	  -1.040501176825
O 	  -1.856563240082	  -7.783552736615	  -1.129969149018
O 	   0.163467415434	  -6.288939610991	  -0.800415943035
C 	  -2.157206740231	  -5.545611436590	   0.283532586589
F 	  -1.620263641878	  -4.349025856800	   0.424831864744
F 	  -3.426604056184	  -5.426150495191	  -0.047003274317
F 	  -2.050415439639	  -6.217559849658	   1.411395119529
24
TS_CCl-PdL1 (VL_PAr3, r0 = 2.0, θ = 120), G = -3500.884362869464
Pd	   1.397186557428	  -0.936482088204	  -3.069118983319
P 	   2.862243267205	   0.477278463142	  -1.970662467160
Cl	   4.387718522446	  -0.429191936121	  -1.035290784915
Cl	   2.048629909531	   1.534801823419	  -0.473000509978
Cl	   3.820587517393	   1.909279423602	  -2.997059979044
C 	   0.125684682135	  -2.284921313752	  -3.748077124188
Cl	   0.506220949400	  -0.774077565341	  -5.328357270824
C 	  -1.129693008244	  -2.169222496704	  -3.139843552650
C 	  -1.736247901839	  -3.323824573542	  -2.652734103928
C 	  -1.096190413587	  -4.548243212992	  -2.819911555105
C 	   0.121865095245	  -4.669510037799	  -3.481695802491
C 	   0.742199035969	  -3.522010290233	  -3.969042323808
H 	  -1.621008077933	  -1.199713056392	  -3.039336006703
H 	  -2.702422476448	  -3.275620348538	  -2.147760740975
H 	   0.581883873508	  -5.649078193261	  -3.617976752503
H 	   1.690284480850	  -3.591294234290	  -4.505583348215
O 	  -1.745884050038	  -5.694943149997	  -2.352250157479
S 	  -1.226988340016	  -6.451743960904	  -1.025039557316
O 	  -1.914832660939	  -7.712290300686	  -1.006832488797
O 	   0.201036172349	  -6.323483102103	  -0.879713741241
C 	  -1.999804421514	  -5.384565824838	   0.296653241985
F 	  -1.372334831446	  -4.225934098864	   0.356722847771
F 	  -3.273252472275	  -5.187337580995	   0.024352706007
F 	  -1.880385002044	  -6.014586514001	   1.447165647819
24
TS_CCl-PdL1 (VL_PAr3, r0 = 2.0, θ = 130), G = -3500.884707450782
Pd	   1.386351981932	  -0.934294051869	  -3.090493159192
P 	   2.849744012464	   0.461143777106	  -1.964868319936
Cl	   4.328237379161	  -0.489185323808	  -0.997957336380
Cl	   2.015069161027	   1.511455098332	  -0.473690456107
Cl	   3.865241054411	   1.887709651495	  -2.942523021314
C 	   0.116095145726	  -2.284893984738	  -3.763588284173
Cl	   0.492350846979	  -0.770961720133	  -5.347739170270
C 	  -1.137055487254	  -2.169478930741	  -3.151017988675
C 	  -1.739180988500	  -3.323832593690	  -2.657695071448
C 	  -1.097253080991	  -4.547435594188	  -2.823768148943
C 	   0.117634336649	  -4.668478926847	  -3.491421424764
C 	   0.733717576493	  -3.521232373876	  -3.984819167783
H 	  -1.629529802617	  -1.200528642448	  -3.050798519609
H 	  -2.702877822166	  -3.275826411258	  -2.147957460956
H 	   0.578856395727	  -5.647627961099	  -3.626717034031
H 	   1.679857219020	  -3.590087163911	  -4.524832875896
O 	  -1.741234060950	  -5.693746549405	  -2.347376422500
S 	  -1.213197110368	  -6.441654572579	  -1.018591762076
O 	  -1.900239584549	  -7.702384907292	  -0.987880790634
O 	   0.215707626890	  -6.311740811525	  -0.883619704968
C 	  -1.977706073111	  -5.366202301242	   0.301440315288
F 	  -1.347654627048	  -4.208622407994	   0.353239551702
F 	  -3.252009480560	  -5.167819758468	   0.033871128601
F 	  -1.854428211224	  -5.990987709235	   1.454412317018
24
TS_CCl-PdL1 (VL_PAr3, r0 = 2.0, θ = 140), G = -3500.885068419959
Pd	   1.378216795786	  -0.932824354056	  -3.109521912009
P 	   2.837840310333	   0.448028237175	  -1.959468361941
Cl	   4.281632084253	  -0.537052772392	  -0.974935858032
Cl	   1.984337634896	   1.482870120934	  -0.468062516804
Cl	   3.892455533354	   1.876795002689	  -2.891236015747
C 	   0.109352313400	  -2.285724762489	  -3.777508507640
Cl	   0.483319522249	  -0.770626556018	  -5.366061044954
C 	  -1.142121786327	  -2.169778357103	  -3.161819133402
C 	  -1.741036765925	  -3.323370529634	  -2.662634236792
C 	  -1.097927508482	  -4.546618017088	  -2.826789896282
C 	   0.114427111622	  -4.668308438724	  -3.498966118151
C 	   0.727488420055	  -3.521827300680	  -3.997978288610
H 	  -1.635414762821	  -1.201125404487	  -3.062768114236
H 	  -2.702847580427	  -3.274751748895	  -2.149373319754
H 	   0.576331646455	  -5.647344326136	  -3.632782013577
H 	   1.672064518231	  -3.591083782865	  -4.540658218284
O 	  -1.737774598106	  -5.691996750981	  -2.342678725990
S 	  -1.202421252896	  -6.432965078447	  -1.012835967378
O 	  -1.890129534822	  -7.693041898715	  -0.971298254142
O 	   0.227369597481	  -6.303312649370	  -0.887097577510
C 	  -1.958365786666	  -5.349720652749	   0.305927344002
F 	  -1.325587868314	  -4.193322772609	   0.349806818174
F 	  -3.233493573166	  -5.149849965886	   0.043293571960
F 	  -1.831218063016	  -5.969761410890	   1.461053540040
24
TS_CCl-PdL1 (VL_PAr3, r0 = 2.0, θ = 150), G = -3500.885416330174
Pd	   1.397567022700	  -0.952632139202	  -3.128328244018
P 	   2.827910672319	   0.436571951475	  -1.951225315492
Cl	   4.467534071778	  -0.473616451907	  -1.239304593685
Cl	   2.013259193545	   1.151261897495	  -0.263047873006
Cl	   3.606368548969	   2.100520430548	  -2.755517190652
C 	   0.133073000697	  -2.308940376665	  -3.795764303235
Cl	   0.535054582544	  -0.811768834601	  -5.399077244828
C 	  -1.121783136285	  -2.178045720706	  -3.190119320583
C 	  -1.731324614869	  -3.322270698644	  -2.682025057628
C 	  -1.095556463656	  -4.551335229385	  -2.829528434728
C 	   0.119675017226	  -4.688386495802	  -3.493725778524
C 	   0.743951312976	  -3.551311838990	  -4.000327229377
H 	  -1.609607187531	  -1.205337576729	  -3.104675944879
H 	  -2.695312048628	  -3.261745171274	  -2.174158342828
H 	   0.575111595193	  -5.671997812940	  -3.615498365812
H 	   1.691528610814	  -3.632699992603	  -4.535974334795
O 	  -1.745850259912	  -5.686699457267	  -2.335835848541
S 	  -1.223988821208	  -6.415178070630	  -0.993725260197
O 	  -1.929278396600	  -7.664796347122	  -0.935664663202
O 	   0.207172210437	  -6.303856520001	  -0.866216578408
C 	  -1.967727925287	  -5.302523591259	   0.307626874731
F 	  -1.318000707823	  -4.155338547615	   0.339245395842
F 	  -3.238824626480	  -5.087105288131	   0.037319979288
F 	  -1.854455243717	  -5.909482288011	   1.471154866992
24
TS_CCl-PdL1 (VL_PAr3, r0 = 2.0, θ = 160), G = -3500.885835310689
Pd	   1.378814547526	  -0.920730326332	  -3.117297124333
P 	   2.852115248969	   0.456551667679	  -1.976926566844
Cl	   4.278020161371	  -0.546229670971	  -0.984172174757
Cl	   2.011244443833	   1.510143517588	  -0.491517138265
Cl	   3.931378241442	   1.863606880998	  -2.913353628273
C 	   0.108388769713	  -2.277299836593	  -3.776869235634
Cl	   0.471915111987	  -0.767290067895	  -5.370043897604
C 	  -1.141867310790	  -2.163640726376	  -3.157908812313
C 	  -1.737141855679	  -3.317827161615	  -2.655574052493
C 	  -1.092012147479	  -4.539952135424	  -2.819509310588
C 	   0.119347534648	  -4.659750888113	  -3.493787505956
C 	   0.728580989685	  -3.512741926226	  -3.996289665756
H 	  -1.637689469009	  -1.196194097646	  -3.059811616489
H 	  -2.698403280143	  -3.271080126482	  -2.141023793338
H 	   0.583043059923	  -5.637957249476	  -3.627814364786
H 	   1.671538472411	  -3.581279592199	  -4.541885412629
O 	  -1.729800225126	  -5.686763374650	  -2.336242278136
S 	  -1.193823600323	  -6.430226382729	  -1.008122936411
O 	  -1.855159634998	  -7.704811369624	  -0.986026319786
O 	   0.231307128928	  -6.271558657633	  -0.864739208910
C 	  -1.988217984363	  -5.377233181478	   0.311897357939
F 	  -1.383867206756	  -4.206273451787	   0.369369042950
F 	  -3.265301999912	  -5.205555628467	   0.039754498436
F 	  -1.855912588658	  -6.002620384503	   1.463501336420
24
TS_CCl-PdL1 (VL_PAr3, r0 = 2.0, θ = 170), G = -3500.886129772090
Pd	   1.386233317550	  -0.915230973094	  -3.107211465965
P 	   2.868037988177	   0.473654860277	  -1.990348245768
Cl	   4.314234181670	  -0.509752607592	  -1.007668015449
Cl	   2.046152201174	   1.545611803354	  -0.507513201927
Cl	   3.927020054310	   1.871177591768	  -2.963570098363
C 	   0.114021303219	  -2.272901899226	  -3.765437673950
Cl	   0.473085598126	  -0.767825544726	  -5.358513277515
C 	  -1.136798554813	  -2.160870163335	  -3.146835751529
C 	  -1.732846969677	  -3.315910003216	  -2.647341742263
C 	  -1.087938734054	  -4.537855781273	  -2.813105458989
C 	   0.124815194198	  -4.656216428336	  -3.485074150858
C 	   0.734531512597	  -3.508385959187	  -3.985035437141
H 	  -1.633374150771	  -1.193852661365	  -3.048410377293
H 	  -2.695237687329	  -3.270432766661	  -2.134707403073
H 	   0.588682921439	  -5.634179399414	  -3.620504840500
H 	   1.677597074671	  -3.576504861725	  -4.530499142452
O 	  -1.728068319865	  -5.686200231277	  -2.336667918314
S 	  -1.198283422653	  -6.436148367774	  -1.009880214453
O 	  -1.845928252226	  -7.717946973036	  -1.005595166623
O 	   0.223351326417	  -6.263185885268	  -0.849707500876
C 	  -2.018710624998	  -5.404355945481	   0.310560699236
F 	  -1.428604628139	  -4.226941786100	   0.383319122546
F 	  -3.294853343920	  -5.244884425993	   0.027055256575
F 	  -1.890621577964	  -6.037575760737	   1.458299197869
24
TS_CCl-PdL1 (VL_PAr3, r0 = 2.0, θ = 180), G = -3500.886331216147
Pd	   1.399506887674	  -0.911392991138	  -3.091008636720
P 	   2.888176326413	   0.496168173248	  -2.004942806949
Cl	   4.375862616759	  -0.450597650744	  -1.048641523551
Cl	   2.090171625358	   1.581181302422	  -0.518605583805
Cl	   3.899703820944	   1.893174358228	  -3.028301132573
C 	   0.124710263868	  -2.269381584309	  -3.749129357886
Cl	   0.482416484083	  -0.771029972285	  -5.342142859327
C 	  -1.127211170582	  -2.157323676887	  -3.132226410704
C 	  -1.726831880148	  -3.312431322822	  -2.637132892530
C 	  -1.084318628546	  -4.535310484802	  -2.804994798938
C 	   0.130578010358	  -4.653837474488	  -3.473036819085
C 	   0.743564141986	  -3.505949911091	  -3.968749657377
H 	  -1.623191634265	  -1.190024505395	  -3.033687670310
H 	  -2.691053874110	  -3.266317578023	  -2.127990523250
H 	   0.592956347191	  -5.632297901434	  -3.610181835525
H 	   1.687161474469	  -3.575122060356	  -4.513139510126
O 	  -1.729842386672	  -5.684501681851	  -2.337941072820
S 	  -1.209005534969	  -6.445386834409	  -1.013994770453
O 	  -1.844173874524	  -7.733345857705	  -1.031729362219
O 	   0.208745371914	  -6.260372423481	  -0.834313820759
C 	  -2.056257330303	  -5.437650222411	   0.307525196606
F 	  -1.481893687868	  -4.253554803346	   0.397119657855
F 	  -3.331280490323	  -5.291462857314	   0.012271273859
F 	  -1.931996471541	  -6.079946209005	   1.450582109533
24
TS_CCl-PdL1 (VL_PAr3, r0 = 2.0, θ = 190), G = -3500.886366708714
Pd	   1.416263033344	  -0.908112992087	  -3.068388935770
P 	   2.907923159458	   0.526237973321	  -2.019740724178
Cl	   4.468607433950	  -0.369918724357	  -1.133856458630
Cl	   2.146870534201	   1.596302843084	  -0.503558794602
Cl	   3.826859512196	   1.948221382390	  -3.094858658491
C 	   0.141984200160	  -2.269118749573	  -3.728272940081
Cl	   0.504431936584	  -0.784040005778	  -5.324316610033
C 	  -1.113148303818	  -2.155077687040	  -3.117660584498
C 	  -1.719646259935	  -3.309024903185	  -2.628196891128
C 	  -1.080810054232	  -4.533906557493	  -2.795211772639
C 	   0.138832164667	  -4.654618030496	  -3.454235089602
C 	   0.758555836051	  -3.507845745506	  -3.943897185818
H 	  -1.608055992780	  -1.186948292617	  -3.022123160189
H 	  -2.687495739721	  -3.260251536954	  -2.126289151232
H 	   0.598841841225	  -5.634253274719	  -3.591007249787
H 	   1.704507018175	  -3.579881125683	  -4.483752801154
O 	  -1.736218352953	  -5.682663781426	  -2.340845076313
S 	  -1.230176980172	  -6.459220383317	  -1.020502169370
O 	  -1.862647284048	  -7.748059565411	  -1.061147397396
O 	   0.184865073907	  -6.273812132734	  -0.821109381354
C 	  -2.096063374736	  -5.469273612141	   0.301761266687
F 	  -1.531550035304	  -4.281509707365	   0.405187995515
F 	  -3.369607088187	  -5.330482570548	  -0.003217426142
F 	  -1.976625870887	  -6.119456989766	   1.440846389129
24
TS_CCl-PdL1 (VL_PAr3, r0 = 2.0, θ = 200), G = -3500.886046658922
Pd	   1.419271850902	  -0.892999582030	  -3.039553220534
P 	   2.930915366588	   0.556463878215	  -2.036109254902
Cl	   4.459574994192	  -0.322961860150	  -1.080488017007
Cl	   2.197996781454	   1.758054003432	  -0.607177534263
Cl	   3.898426139571	   1.868839368915	  -3.204147226204
C 	   0.143084623030	  -2.256251952448	  -3.699441654061
Cl	   0.489318748939	  -0.770616703557	  -5.289087708676
C 	  -1.111959423142	  -2.150260099259	  -3.086540111545
C 	  -1.717154691549	  -3.309125514123	  -2.607319741850
C 	  -1.077233693807	  -4.531906852497	  -2.785382795895
C 	   0.143969962067	  -4.644652726692	  -3.442786299003
C 	   0.761777991961	  -3.492869531209	  -3.922935842318
H 	  -1.609488127612	  -1.184193277876	  -2.984305757828
H 	  -2.685806149112	  -3.265656583654	  -2.106454732015
H 	   0.605769570378	  -5.622393399706	  -3.587246112541
H 	   1.706985964589	  -3.559716584848	  -4.464673624224
O 	  -1.733901144495	  -5.686473477265	  -2.347691390986
S 	  -1.235809447734	  -6.478258368400	  -1.033550975707
O 	  -1.854961070074	  -7.772589182705	  -1.099915947614
O 	   0.174891653192	  -6.281771825845	  -0.815072054515
C 	  -2.127671429211	  -5.516226891614	   0.291652962932
F 	  -1.578769441085	  -4.323150916901	   0.415932091058
F 	  -3.399371004887	  -5.388950321901	  -0.026012488404
F 	  -2.013361617007	  -6.179045767331	   1.423914629031
24
TS_CCl-PdL1 (VL_PAr3, r0 = 2.0, θ = 210), G = -3500.885444997868
Pd	   1.440462281191	  -0.882640138982	  -3.008698424609
P 	   2.959612449225	   0.602830162915	  -2.064084049710
Cl	   4.533941336651	  -0.225308064774	  -1.137371023472
Cl	   2.256214461965	   1.838401871971	  -0.649380422185
Cl	   3.865809128759	   1.894631528269	  -3.302282614399
C 	   0.162243490256	  -2.251556872312	  -3.665207960541
Cl	   0.503132200819	  -0.786336972295	  -5.258247950325
C 	  -1.094477906547	  -2.144760160869	  -3.054768152659
C 	  -1.707204366506	  -3.303361707421	  -2.584716345773
C 	  -1.073604148452	  -4.528457757600	  -2.768996085701
C 	   0.152222052871	  -4.642298438254	  -3.417573548200
C 	   0.777442910889	  -3.490627828772	  -3.887834508443
H 	  -1.590385911335	  -1.177948293586	  -2.952180347419
H 	  -2.678696226658	  -3.258136002081	  -2.089537847150
H 	   0.610165381979	  -5.621225953134	  -3.566209672130
H 	   1.723713957544	  -3.559801013249	  -4.427255662590
O 	  -1.744295145123	  -5.683224016519	  -2.353562413450
S 	  -1.265846772423	  -6.504213914119	  -1.050576998268
O 	  -1.890439696305	  -7.793919605541	  -1.150025723350
O 	   0.143039791237	  -6.319304307751	  -0.811451535071
C 	  -2.169747157738	  -5.563314007427	   0.280815704966
F 	  -1.626208712463	  -4.369778879303	   0.423244726893
F 	  -3.439683501397	  -5.436857916169	  -0.044167043056
F 	  -2.060913491278	  -6.239505882445	   1.405675089568
24
TS_CCl-PdL1 (VL_PAr3, r0 = 2.1, θ = 120), G = -3500.887200361259
Pd	   1.400072518993	  -0.939303707266	  -3.086222829384
P 	   2.837509818625	   0.472623216204	  -2.004732454715
Cl	   4.451978359599	  -0.441343669586	  -1.027515882774
Cl	   2.002190278414	   1.549592954023	  -0.411261597673
Cl	   3.840415600480	   2.014926064258	  -3.010398491370
C 	   0.130821744969	  -2.302962750155	  -3.741184523231
Cl	   0.543087531740	  -0.763467963488	  -5.343109751383
C 	  -1.125337753717	  -2.175941260074	  -3.141506102350
C 	  -1.739460070646	  -3.327967045793	  -2.656655616432
C 	  -1.103993432063	  -4.555173401057	  -2.820993139063
C 	   0.114859873841	  -4.683480618978	  -3.480224185205
C 	   0.743829353738	  -3.539044491400	  -3.964397648535
H 	  -1.610952619067	  -1.203506728135	  -3.041852428984
H 	  -2.706924564983	  -3.274780494992	  -2.154732014128
H 	   0.569607498487	  -5.665462090435	  -3.616338969697
H 	   1.694196775934	  -3.612218722634	  -4.496191040288
O 	  -1.758556125281	  -5.697027241492	  -2.351405373915
S 	  -1.239538251639	  -6.457311112782	  -1.024783745277
O 	  -1.937073028748	  -7.712228542440	  -1.003337205626
O 	   0.190022052248	  -6.339276316761	  -0.886766709966
C 	  -1.998512786557	  -5.381249755585	   0.297945640776
F 	  -1.363369132297	  -4.226430588057	   0.350345490163
F 	  -3.271952980196	  -5.177307971642	   0.031426016609
F 	  -1.876424254714	  -6.008371931129	   1.449499755390
24
TS_CCl-PdL1 (VL_PAr3, r0 = 2.1, θ = 130), G = -3500.887450951202
Pd	   1.376442763543	  -0.924775277213	  -3.097717444175
P 	   2.827055157113	   0.463431177186	  -2.002138391957
Cl	   4.212914110327	  -0.521690265263	  -0.774785010437
Cl	   1.956967335987	   1.761975409310	  -0.604511070857
Cl	   4.101944596698	   1.789314221503	  -3.008201202304
C 	   0.102533013880	  -2.286622028184	  -3.745816718832
Cl	   0.485279369480	  -0.729494796832	  -5.338995755797
C 	  -1.146723137522	  -2.169361336982	  -3.129918583957
C 	  -1.749328762208	  -3.327295353311	  -2.644768657800
C 	  -1.109741189507	  -4.550315892709	  -2.824201058190
C 	   0.101200556445	  -4.668645787534	  -3.499567181416
C 	   0.718432436697	  -3.518231228509	  -3.984814037192
H 	  -1.635511967404	  -1.199845369346	  -3.018077254918
H 	  -2.710947221095	  -3.281938230624	  -2.130922775818
H 	   0.559330374164	  -5.647569773120	  -3.646208047267
H 	   1.662640301250	  -3.583259266448	  -4.528536142813
O 	  -1.751586169459	  -5.698157183800	  -2.351688780163
S 	  -1.210057378819	  -6.460081116258	  -1.034958092364
O 	  -1.901179662541	  -7.718407954941	  -1.007504111167
O 	   0.220747164883	  -6.335318365393	  -0.917403370738
C 	  -1.954620646040	  -5.391705208290	   0.302260719212
F 	  -1.320521774910	  -4.236199721920	   0.352064962520
F 	  -3.231627431300	  -5.188654298213	   0.052708020457
F 	  -1.817145432507	  -6.023866522530	   1.449307178899
24
TS_CCl-PdL1 (VL_PAr3, r0 = 2.1, θ = 140), G = -3500.887858516589
Pd	   1.369164958453	  -0.922850006310	  -3.119849545157
P 	   2.815432007609	   0.452097828317	  -1.999387773805
Cl	   4.156684972459	  -0.573218337629	  -0.755380561583
Cl	   1.928430727762	   1.734181314352	  -0.597188783887
Cl	   4.133136942441	   1.778357622713	  -2.948019892926
C 	   0.096323829562	  -2.287492733440	  -3.761347056683
Cl	   0.475503694338	  -0.731782781100	  -5.360527133025
C 	  -1.150920787909	  -2.168783681750	  -3.141738697066
C 	  -1.750522671690	  -3.325344376795	  -2.649477979055
C 	  -1.110456338190	  -4.548439189584	  -2.826586412888
C 	   0.097589582050	  -4.668407308137	  -3.506903491924
C 	   0.712125788121	  -3.519363952749	  -3.998830667682
H 	  -1.640160216131	  -1.199281500994	  -3.031763215448
H 	  -2.710011193161	  -3.278686276604	  -2.131729042988
H 	   0.555780823264	  -5.647572760016	  -3.651756287477
H 	   1.654393980378	  -3.585625738829	  -4.545743124446
O 	  -1.748746834068	  -5.694767658672	  -2.345760004337
S 	  -1.199143388513	  -6.450858316421	  -1.028928932256
O 	  -1.890289150949	  -7.708905580861	  -0.991592974200
O 	   0.232377032838	  -6.325810272817	  -0.920928835170
C 	  -1.935149039588	  -5.376184716145	   0.308000262821
F 	  -1.299616752299	  -4.221194046019	   0.349713622695
F 	  -3.213295192703	  -5.172872127938	   0.064521822777
F 	  -1.792136366931	  -6.003909571963	   1.456811896647
24
TS_CCl-PdL1 (VL_PAr3, r0 = 2.1, θ = 150), G = -3500.888348025995
Pd	   1.368676775540	  -0.918459027561	  -3.129514718756
P 	   2.817800545081	   0.452034582081	  -2.005285760570
Cl	   4.147247630485	  -0.587952405495	  -0.760721002567
Cl	   1.930921636655	   1.728757984166	  -0.598117669811
Cl	   4.147564220242	   1.776787722782	  -2.939021326992
C 	   0.095310470526	  -2.285105287573	  -3.765589091493
Cl	   0.469337337962	  -0.731477572617	  -5.368407830663
C 	  -1.150895288467	  -2.166525985586	  -3.143774447927
C 	  -1.748532327072	  -3.322736002088	  -2.648243133468
C 	  -1.107825773323	  -4.545608478594	  -2.824382607846
C 	   0.098991525662	  -4.665639771397	  -3.506870415137
C 	   0.711552748209	  -3.516960384226	  -4.002181451181
H 	  -1.641016227678	  -1.197366872487	  -3.034749583640
H 	  -2.707218834618	  -3.276014006193	  -2.129014394997
H 	   0.557634349535	  -5.644686348490	  -3.651221107102
H 	   1.652609127554	  -3.583572015047	  -4.551134272915
O 	  -1.744590436426	  -5.691892635619	  -2.341506760364
S 	  -1.193357976717	  -6.447016551128	  -1.024790686755
O 	  -1.874665638499	  -7.710540975918	  -0.992462250754
O 	   0.236734790617	  -6.310842734640	  -0.911730970125
C 	  -1.942834755169	  -5.381676920065	   0.311889223229
F 	  -1.318190271515	  -4.220860037061	   0.356464364342
F 	  -3.222174788002	  -5.189808250770	   0.065764429003
F 	  -1.796582433436	  -6.009552195902	   1.460208659411
24
TS_CCl-PdL1 (VL_PAr3, r0 = 2.1, θ = 160), G = -3500.888608265083
Pd	   1.373161640256	  -0.910369730184	  -3.126242835472
P 	   2.835588297614	   0.463032736621	  -2.021415128651
Cl	   4.190503670365	  -0.571070153066	  -0.799637381604
Cl	   1.970379993132	   1.740046045051	  -0.601094409174
Cl	   4.144899330336	   1.789154467013	  -2.981735831283
C 	   0.098095705812	  -2.278747919486	  -3.757950293813
Cl	   0.463639968254	  -0.728030333979	  -5.361680054643
C 	  -1.148214664478	  -2.163312414671	  -3.135444250402
C 	  -1.743835349773	  -3.321004016672	  -2.640946107514
C 	  -1.100966088496	  -4.542596163754	  -2.817723941631
C 	   0.106599234394	  -4.659715077123	  -3.499288756639
C 	   0.716694313251	  -3.509626541689	  -3.994403166828
H 	  -1.640560669776	  -1.195314809037	  -3.026265077700
H 	  -2.703207359075	  -3.276974794498	  -2.122684141876
H 	   0.567183463329	  -5.637773329125	  -3.644436297357
H 	   1.657380984593	  -3.574533320851	  -4.544217958779
O 	  -1.736903621183	  -5.691146830668	  -2.339263350926
S 	  -1.190994984642	  -6.447251078924	  -1.021005982039
O 	  -1.849201843409	  -7.723366388860	  -1.008051969500
O 	   0.234505583187	  -6.285477078588	  -0.885821633753
C 	  -1.980700889586	  -5.407791453134	   0.312620433944
F 	  -1.379150157547	  -4.235516445255	   0.374203151690
F 	  -3.259780421941	  -5.237999270424	   0.049811462918
F 	  -1.838619727476	  -6.041330268100	   1.458280713982
24
TS_CCl-PdL1 (VL_PAr3, r0 = 2.1, θ = 170), G = -3500.888933050623
Pd	   1.378449956162	  -0.901437132265	  -3.113275145635
P 	   2.854713224875	   0.479855790374	  -2.035915934860
Cl	   4.256529864310	  -0.537395940296	  -0.853634440588
Cl	   2.024737444995	   1.759308328175	  -0.596913619566
Cl	   4.120950003902	   1.810761186019	  -3.046150342822
C 	   0.104114145322	  -2.272724164678	  -3.744373610741
Cl	   0.466472367528	  -0.726908591584	  -5.348737142861
C 	  -1.144228664742	  -2.160278855253	  -3.125048180255
C 	  -1.740005230544	  -3.319385086987	  -2.633965543645
C 	  -1.095183413995	  -4.539958514606	  -2.810242436845
C 	   0.115366096146	  -4.654337573439	  -3.486910458452
C 	   0.725245894861	  -3.502876585256	  -3.979029146806
H 	  -1.638885344323	  -1.193340558905	  -3.017095980683
H 	  -2.701677424202	  -3.277552330558	  -2.119734388561
H 	   0.577940486342	  -5.631510518435	  -3.631927192765
H 	   1.667275583075	  -3.566396745619	  -4.526709775123
O 	  -1.732611750778	  -5.690671031332	  -2.339042028663
S 	  -1.194610803956	  -6.451264486157	  -1.020270122786
O 	  -1.831800839236	  -7.738082590225	  -1.028975792272
O 	   0.225684047916	  -6.267208613373	  -0.861344042101
C 	  -2.022584611677	  -5.439047980639	   0.310642019791
F 	  -1.442553498336	  -4.257056215047	   0.391488273880
F 	  -3.300313212722	  -5.288685423044	   0.030229372841
F 	  -1.886527913787	  -6.080520536278	   1.452542852448
24
TS_CCl-PdL1 (VL_PAr3, r0 = 2.1, θ = 180), G = -3500.889123529238
Pd	   1.387623187415	  -0.895932579269	  -3.091546558765
P 	   2.872097956386	   0.502123448311	  -2.046172573482
Cl	   4.336752009746	  -0.479444785212	  -0.910998671471
Cl	   2.076868945549	   1.785513158306	  -0.591183121540
Cl	   4.075088230702	   1.842846115886	  -3.118915541330
C 	   0.114591357165	  -2.269903854291	  -3.724857891258
Cl	   0.477881637721	  -0.729597867994	  -5.328972419913
C 	  -1.136934220786	  -2.159177346304	  -3.111291599632
C 	  -1.736170877471	  -3.319241297750	  -2.626704503667
C 	  -1.091455669331	  -4.539841901929	  -2.803064726759
C 	   0.123532147978	  -4.652671219823	  -3.471968861738
C 	   0.736516932329	  -3.500190673280	  -3.957789699453
H 	  -1.632618116870	  -1.192649865368	  -3.004538201973
H 	  -2.701207419105	  -3.278121886499	  -2.118762326662
H 	   0.586593912291	  -5.629600925061	  -3.617202867343
H 	   1.680903028919	  -3.563385966009	  -4.501409815041
O 	  -1.734321292841	  -5.692071226656	  -2.342937836969
S 	  -1.208611387977	  -6.462404266517	  -1.025038974439
O 	  -1.839189084431	  -7.752229965082	  -1.052650449726
O 	   0.208635086977	  -6.272711322197	  -0.847091764215
C 	  -2.058270023297	  -5.466948364138	   0.304409669729
F 	  -1.488205835822	  -4.281204410998	   0.399932104904
F 	  -3.334007480362	  -5.324138140331	   0.011371376504
F 	  -1.929596617735	  -6.115729027209	   1.442992447170
24
TS_CCl-PdL1 (VL_PAr3, r0 = 2.1, θ = 190), G = -3500.889141689343
Pd	   1.402420889772	  -0.892237407082	  -3.066916048912
P 	   2.891836544586	   0.528458374247	  -2.057302046471
Cl	   4.384100727696	  -0.403611821005	  -0.916492248871
Cl	   2.116039163125	   1.863165230190	  -0.638518191020
Cl	   4.068030494190	   1.834927518539	  -3.199899556087
C 	   0.125905432200	  -2.265570710484	  -3.701523839439
Cl	   0.487122359227	  -0.728996265495	  -5.302741288715
C 	  -1.126621929780	  -2.155081279271	  -3.089442190111
C 	  -1.731135940569	  -3.315686372821	  -2.612813086392
C 	  -1.090551797830	  -4.537618042660	  -2.794837749114
C 	   0.126516849182	  -4.650272117065	  -3.459970413209
C 	   0.744397457735	  -3.497141685395	  -3.937973935734
H 	  -1.620603141706	  -1.188007539902	  -2.979903631479
H 	  -2.697913006840	  -3.273672363093	  -2.108269855764
H 	   0.586856416837	  -5.627838044144	  -3.609649907825
H 	   1.689207445659	  -3.561182088357	  -4.480704066573
O 	  -1.740818597949	  -5.690875816688	  -2.347676531345
S 	  -1.224526189129	  -6.478669155021	  -1.036551652042
O 	  -1.851598886093	  -7.769650485209	  -1.086931239821
O 	   0.190637603358	  -6.287817089231	  -0.843750603898
C 	  -2.088846493610	  -5.503876091501	   0.298271887507
F 	  -1.529237491190	  -4.314227136558	   0.407672185516
F 	  -3.364284176726	  -5.369052562988	   0.000142299709
F 	  -1.960437324994	  -6.162181218401	   1.431388903020
24
TS_CCl-PdL1 (VL_PAr3, r0 = 2.1, θ = 200), G = -3500.888824357944
Pd	   1.419208982671	  -0.885650803234	  -3.041144547064
P 	   2.915176914301	   0.560193208737	  -2.072874126742
Cl	   4.450007965307	  -0.321617105659	  -0.948814502708
Cl	   2.161967339127	   1.931707971715	  -0.677285181107
Cl	   4.045766240117	   1.844787159032	  -3.284375131081
C 	   0.140335954824	  -2.261048447445	  -3.674618441106
Cl	   0.498289047929	  -0.733219746878	  -5.276283909160
C 	  -1.113556464338	  -2.150670764000	  -3.064711494391
C 	  -1.723824383030	  -3.311567069010	  -2.596249291850
C 	  -1.087809889818	  -4.534976416579	  -2.783943137353
C 	   0.132236782101	  -4.647696445846	  -3.443561446116
C 	   0.755624207185	  -3.494114129042	  -3.913145112784
H 	  -1.606083019215	  -1.183097571885	  -2.953339405058
H 	  -2.692541944839	  -3.268522841769	  -2.095551037878
H 	   0.589758635238	  -5.625968471627	  -3.597345494396
H 	   1.701174688645	  -3.559357551595	  -4.454330673511
O 	  -1.747281002054	  -5.689052877044	  -2.352508640358
S 	  -1.244308494019	  -6.496645228484	  -1.048485036343
O 	  -1.867590435297	  -7.788198188471	  -1.125602827476
O 	   0.168006566436	  -6.305489180361	  -0.836422563593
C 	  -2.126867740680	  -5.544390679489	   0.289920592588
F 	  -1.579921882886	  -4.350374096414	   0.414473760327
F 	  -3.401479795922	  -5.419454369524	  -0.015750674161
F 	  -1.999791864628	  -6.212290524522	   1.417555514262
24
TS_CCl-PdL1 (VL_PAr3, r0 = 2.1, θ = 210), G = -3500.888299271544
Pd	   1.449171393366	  -0.867385852623	  -2.996906605481
P 	   2.952841343687	   0.627547657948	  -2.119640345549
Cl	   4.593046890418	  -0.187010660651	  -1.098334650024
Cl	   2.243909652029	   1.979943152819	  -0.682683646977
Cl	   3.945731251386	   1.947965992590	  -3.410641522745
C 	   0.172405611177	  -2.256878908126	  -3.623470788207
Cl	   0.527590957905	  -0.768992645280	  -5.236707528441
C 	  -1.087846785996	  -2.145823891533	  -3.025496988638
C 	  -1.709475755159	  -3.305960104984	  -2.570679538397
C 	  -1.078852625330	  -4.531923084914	  -2.759663208892
C 	   0.152664729477	  -4.645947140964	  -3.397399390374
C 	   0.787294542935	  -3.492788831963	  -3.851995480049
H 	  -1.580372173065	  -1.177676597550	  -2.919690054776
H 	  -2.685775883684	  -3.260887979266	  -2.085154875963
H 	   0.607667236639	  -5.625335552324	  -3.551397393471
H 	   1.738208191171	  -3.561011565478	  -4.383180275714
O 	  -1.759826092587	  -5.685785745088	  -2.362405482959
S 	  -1.292611273135	  -6.533205998934	  -1.071283536999
O 	  -1.929965860534	  -7.814444141415	  -1.194275721858
O 	   0.117394669834	  -6.365616009008	  -0.826574337454
C 	  -2.190997464571	  -5.603046318570	   0.271252492449
F 	  -1.641226129663	  -4.413741786415	   0.425017803508
F 	  -3.460310888593	  -5.467285612044	  -0.051700933225
F 	  -2.084169130548	  -6.291422545634	   1.388619203161
