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VLCS-00022 1356019-55-0 CHClNOS 387.84 VLCS-00006 99614-01-4 VLCS-00022 1356019-55-0 VLCS-00025 187731-34-6 VLCS-00027 184866-29-3 VLCS-00053 99614-01-4 VLCS-00076 5051-22-9 VLCS-00079 4199-10-04 VLCS-00087 1217724-52-1 VLCS-00088 1217740-02-7 VLIM-00272 128486-89-5 VLIM-00277 113994-41-5 (free base) VLME-00012 144750-42-5 VLME-00030 130606-60-9 VLME-00031 56296-78-7 VLME-00042 292055-72-2 VLME-00043 153365-82-3 VLME-00046 294882-33-0 VLME-00047 84333-59-5 VLME-00050 67812-42-4 VLME-00052 NA VLME-00064 16179-97-8 VLME-00069 357399-43-0 VLME-00093 1246638-08-3 VLME-00133 14133-90-5 VLME-00157 1348803-59-7 VLME-00221 3953-65-9 VLME-00223 733043-41-9 VLME-00226 142047-93-6 VLME-00235 23541-50-6 VLME-00252 15917-65-4 VLME-00290 1346603-24-4 VLME-00354 176671-73-1 VLST-00020 81403-68-1 VLST-00023 6398-98-7 VLST-00025 23828-92-4 VLST-00027 19774-82-4 VLST-00030 549-18-8 VLST-00036 137-88-2 VLST-00049 82248-59-7 VLST-00056 2016-88-8 VLST-00063 78613-38-4 VLST-00064 665-66-7 VLST-00083 1119-34-2 VLST-00107 122852-69-1 VLST-00108 185104-11-4 VLST-00113 34381-68-5 VLST-00119 86541-74-4 VLST-00120 3543-75-7 VLST-00125 1235-82-1 VLST-00132 611-75-6 VLST-00135 18010-40-7 VLST-00136 31677-93-7 VLST-00138 33386-08-02 VLST-00150 63659-19-8 VLST-00161 81732-46-9 VLST-00162 101827-46-7 VLST-00171 132-69-4 VLST-00180 590-46-5 VLST-00201 91599-74-5 VLST-00230 107648-80-6 VLST-00253 69-09-0 VLST-00260 364782-34-3 VLST-00263 86483-48-9 VLST-00273 21462-39-5 VLST-00278 17321-77-6 VLST-00279 4205-91-8 VLST-00290 6202-23-9 VLST-00310 5870-29-1 VLST-00316 969-33-5 VLST-00321 83881-52-1 VLST-00323 57470-78-7 VLST-00334 61-12-1 VLST-00341 64-72-2 VLST-00386 1083076-69-0 VLST-00399 58-28-6 VLST-00407 145108-58-3 VLST-00412 5355-16-8 VLST-00414 67-92-5 VLST-00416 33286-22-5 VLST-00417 147-24-0 VLST-00421 49745-95-1 VLST-00428 130693-82-2 VLST-00433 25316-40-9 VLST-00437 0985-12-6 VLST-00438 136434-34-9 VLST-00441 129938-20-1 VLST-00445 62-31-7 VLST-00456 64019-93-8 VLST-00467 10592-13-9 VLST-00469 141625-93-6 VLST-00494 1229-29-4 VLST-00502 897-15-4 VLST-00519 56839-43-1 VLST-00521 10402-53-6 VLST-00525 183319-69-9 VLST-00530 1070-11-7 VLST-00570 68278-23-9 VLST-00597 153439-40-8 VLST-00601 2709-56-0 VLST-00603 30484-77-6 VLST-00606 56296-78-7 VLST-00626 105628-07-7 VLST-00634 3717-88-2 VLST-00648 162359-56-0 VLST-00670 107007-99-8 VLST-00682 122111-03-9 VLST-00691 29110-48-3 VLST-00697 2192-20-3 VLST-00713 304-20-1 VLST-00736 136572-09-3 VLST-00740 579-56-6 VLST-00745 148849-67-6 VLST-00751 6798-24-9 VLST-00753 57852-57-0 VLST-00756 51-30-9 VLST-00803 79794-75-5 VLST-00811 34552-83-5 VLST-00814 73-78-9 VLST-00817 859-18-7 VLST-00821 16595-80-5 VLST-00826 98079-52-8 VLST-00833 367514-88-3 VLST-00853 2753-45-9 VLST-00856 51773-92-3 VLST-00861 1115-70-4 VLST-00865 2576-84-3 VLST-00875 101152-94-7 VLST-00876 13614-98-7 VLST-00893 186826-86-8 VLST-00922 207516-99-2 VLST-00923 31884-77-2 VLST-00924 74536-44-0 VLST-00929 43218-56-0 VLST-00943 152520-56-4 VLST-00945 56391-57-2 VLST-00960 894-71-3 VLST-00966 54527-84-3 VLST-00967 143388-64-1 VLST-00977 923288-95-3 VLST-00978 65473-14-5 VLST-00979 16676-29-2 VLST-00987 0357-08-04 VLST-00999 1508-65-2 VLST-01000 70775-75-6 VLST-01007 2058-46-0 VLST-01008 140462-76-6 VLST-01024 2315-02-08 VLST-01034 135729-62-3 VLST-01040 834-28-6 VLST-01052 1786-81-8 VLST-01057 58-56-0 VLST-01058 112529-15-4 VLST-01059 318-98-9 VLST-01064 389574-19-0 VLST-01069 191217-81-9 VLST-01070 637-58-1 VLST-01071 19237-84-4 VLST-01094 62929-91-3 VLST-01095 1508-76-5 VLST-01097 34183-22-7 VLST-01099 78246-49-8 VLST-01114 637-32-1 VLST-01119 1187830-84-7 VLST-01143 1248-42-6 VLST-01158 82586-55-8 VLST-01160 60-93-5 VLST-01168 66357-59-3 VLST-01169 95635-56-6 VLST-01180 927-421-0 VLST-01181 23239-51-2 VLST-01194 91374-20-8 VLST-01202 132112-35-7 VLST-01203 132907-72-3 VLST-01224 135159-51-2 VLST-01227 79559-97-0 VLST-01228 14611-52-0 VLST-01230 152751-57-0 VLST-01231 84485-00-7 VLST-01267 959-24-0 VLST-01307 106463-17-6 VLST-01313 78628-80-5 VLST-01319 145821-59-6 VLST-01322 53885-35-1 VLST-01328 3644-61-9 VLST-01342 64-75-5 VLST-01344 13171-25-0 VLST-01360 64461-82-1 VLST-01361 70024-40-7 VLST-01363 4548-34-9 VLST-01367 175591-09-0 VLST-01405 25332-39-2 VLST-01423 64887-14-5 VLST-01434 1404-93-9 VLST-01435 99300-78-4 VLST-01436 330808-88-3 VLST-01444 67-03-8 VLST-01446 5103-96-8 VLST-01466 1391054-02-6 VLST-01469 23076-35-9 VLST-01475 138982-67-9 VLDL-00001 1219908-86-7 VLDL-00025 NA VLDL-00043 1216894-33-5 VLDL-00050 1286632-72-1 VLDL-00059 NA VLDL-00066 1189685-70-8 free base VLDL-00070 NA VLDL-00072 1432061-73-8 VLDL-00080 1185097-33-9 VLDL-00085 1173018-49-9 VLDL-00095 1129526-19-7 VLDL-00102 1216761-39-5 VLDL-00104 1426174-78-8 VLDL-00107 NA VLDL-00108 NA VLDL-00113 1219802-60-4 VLDL-00158 NA VLDL-00165 1219798-88-5 VLDL-00167 1185132-92-6 VLDL-00187 1217858-50-8 VLDL-00189 85650-52-8 unlabeled free base VLDL-00190 1261393-48-9 VLDL-00191 1184983-42-3 VLDL-00202 NA VLDL-00208 1261392-62-4 VLDL-00209 2140263-19-8 VLDL-00215 2750534-79-1 VLDL-00217 1324717-75-0 VLDL-00218 613439-56-7 VLDL-00229 346604-90-7 VLDL-00233 1261392-55-5 VLDL-00234 1261393-91-2 free base VLDL-00254 1329809-23-5 VLDL-00257 1346598-70-6 VLDL-00262 1309934-06-2 VLDL-00263 1217741-83-7 VLDL-00266 1346597-27-0 VLDL-00268 1189574-93-3 VLDL-00273 NA VLDL-00275 203784-52-5 VLDL-00276 203645-63-0 VLDL-00278 1217854-43-7 VLDL-00286 2748471-29-4 VLDL-00289 1219795-16-0 VLDL-00292 NA VLDL-00311 1188265-43-1 VLDL-00322 1185514-83-3 VLDL-00348 1189971-04-7 VLDL-00426 NA VLDL-00530 1329556-63-9 VLDL-00541 364752-34-3(unlabelled) VLDL-00542 1329614-18-7 VLDL-00548 1219805-04-5 VLDL-00550 1346603-30-2 VLDL-00552 486460-32-6 (unlabelled) VLDL-00568 67151-02-4 VLDL-00618 NA VLDL-00623 NA VLDL-00693 NA VLDL-00701 1260619-56-4 VLDL-00705 43491-57-0 (Unlabeled) VLME-00791 135308-76-8 VLME-00869 51938-11-5 VLCS-01599 1279033-32-7 VLST-02021 67812-42-4 VLST-02216 224789-15-5 VLDL-01762 NA VLDL-01772 1261396-31-9 VLDL-01773 1188263-47-9 VLDL-01791 1210610-07-3 VLDL-01799 1246814-52-7(Freebase) VLDL-01843 1189959-13-4 VLDL-01851 61361-34-0 VLDL-01852 1219799-06-0 VLDL-01853 1130050-35-9 VLDL-01858 148870-59-1 unlabeled free base VLDL-01861 1133210-23-7 VLDL-01881 NA VLDL-01937 2747914-23-2 VLDL-01940 Unlabelled: 46868-19-3 VLDL-01942 1246820-85-8 VLDL-01952 347840-07-7 VLDL-01967 2749628-08-6 VLDL-01991 1329835-60-0 VLDL-02001 1062606-12-5 VLDL-02012 1432061-50-1 VLDL-02017 877399-54-7 unlabeled VLDL-02018 1356929-58-2 VLDL-02022 1216659-54-9 VLDL-02032 N/A VLDL-02033 1185166-01-1 VLDL-02037 1432061-50-1 VLDL-02043 1185151-95-4 VLDL-02044 1189921-12-7 VLDL-02046 2509098-78-4 VLDL-02056 NA VLDL-02075 NA VLDL-02080 1006717-55-0 VLDL-02098 1246818-80-3 (free base) VLDL-02108 934660-93-2 (unlabeled) VLDL-02109 2070015-04-0 VLDL-02125 170098-43-8 unlabeled VLDL-02128 104757-53-1 (non-labelled) VLSC-00057 103831-11-4 VLDL-02135 NA VLDL-02147 146-56-5

Molecular-dynamics with coupling to an external bath