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0 0 0 0\n 30.7975 -31.9597 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 31.3911 -32.3041 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 30.7962 -31.2784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 30.0599 -33.2443 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 30.7999 -33.6698 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0\n 30.8033 -34.5243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 30.0622 -34.9545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 29.3229 -34.5279 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 28.5846 -34.9550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 27.9884 -34.6136 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 31.5464 -34.9525 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 31.5498 -35.8069 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0\n 32.2898 -36.2325 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 32.2905 -37.0900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 33.0305 -37.5156 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 33.7999 -37.1566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 34.3743 -37.7887 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0\n 33.9484 -38.5316 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 33.1138 -38.3550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 32.5425 -38.9922 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 32.8117 -39.8058 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 33.6491 -39.9794 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 34.2176 -39.3452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 33.0281 -35.8054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 33.7674 -36.2321 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0\n 34.5115 -35.8046 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 34.5083 -34.9501 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 33.7683 -34.5245 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 33.7617 -33.6673 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 33.0218 -33.2418 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 33.0213 -32.5574 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0\n 35.2516 -36.2301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 35.2550 -37.0845 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0\n 35.9950 -37.5101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 35.9956 -38.3676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 36.7384 -38.7900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 36.7390 -39.6475 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 37.4821 -40.0759 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 37.4853 -40.7571 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0\n 36.7333 -37.0829 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0\n 36.7347 -36.3986 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0\n 37.3295 -37.4243 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0\n 35.8425 -35.8862 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0\n 33.0295 -35.1211 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0\n 32.1373 -34.6087 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0\n 29.4690 -33.5881 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0\n 29.9040 -30.7661 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0\n 27.2386 -29.7482 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0\n 27.6765 -26.9231 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0\n 25.0081 -25.9025 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0\n 25.4431 -23.0805 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0\n 22.7778 -22.0626 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0\n 22.5680 -17.7990 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0\n 22.3073 -16.9884 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0\n 19.5283 -15.6595 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0\n 18.6922 -15.4801 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0\n 14.9127 -13.5271 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0\n 12.6908 -15.3207 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0\n 10.4681 -13.5292 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0\n 8.2493 -15.3256 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0\n 6.0235 -13.5314 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0\n 3.8048 -15.3277 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0\n 1.5821 -13.5363 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0\n -0.6398 -15.3299 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0\n 1 2 2 0\n 2 3 1 0\n 4 3 1 1\n 4 5 1 0\n 5 6 1 0\n 6 7 1 0\n 7 8 1 0\n 8 9 1 0\n 4 10 1 0\n 10 11 1 0\n 10 12 2 0\n 2 13 1 0\n 13 14 1 1\n 14 15 1 0\n 15 16 1 0\n 16 17 1 0\n 17 18 1 0\n 13 19 1 0\n 19 20 1 0\n 21 20 1 6\n 21 22 1 0\n 22 23 1 0\n 23 24 2 0\n 24 25 1 0\n 25 26 1 0\n 26 27 2 0\n 27 23 1 0\n 27 28 1 0\n 28 29 2 0\n 29 30 1 0\n 30 31 2 0\n 31 26 1 0\n 21 32 1 0\n 32 33 1 0\n 33 34 1 0\n 34 35 1 6\n 35 36 1 0\n 36 37 1 0\n 37 38 1 0\n 34 39 1 0\n 39 40 1 0\n 40 41 1 0\n 41 42 1 0\n 42 43 1 0\n 42 44 1 0\n 41 45 1 1\n 45 46 1 0\n 46 47 1 0\n 47 48 1 0\n 48 49 1 0\n 48 50 1 0\n 47 51 1 6\n 51 52 1 0\n 52 53 1 0\n 53 54 1 1\n 54 55 1 0\n 55 56 2 0\n 56 57 1 0\n 57 58 2 0\n 58 59 1 0\n 58 60 1 0\n 60 61 2 0\n 61 55 1 0\n 53 62 1 0\n 62 63 1 0\n 63 64 1 0\n 64 65 1 6\n 65 66 1 0\n 66 67 2 0\n 67 68 1 0\n 68 69 2 0\n 69 70 1 0\n 70 71 2 0\n 71 66 1 0\n 64 72 1 0\n 72 73 1 0\n 73 74 1 0\n 74 75 1 1\n 75 76 1 0\n 76 77 1 0\n 77 78 1 0\n 78 79 1 0\n 79 80 1 0\n 79 81 2 0\n 74 82 1 0\n 82 83 1 0\n 82 84 1 0\n 84 85 1 0\n 85 86 1 1\n 86 87 1 0\n 87 88 1 0\n 88 89 1 0\n 89 90 1 0\n 85 91 1 0\n 91 92 1 0\n 92 93 1 0\n 93 94 1 0\n 94 95 1 0\n 95 96 1 0\n 96 97 1 0\n 97 98 1 0\n 98 99 2 0\n 99100 1 0\n100101 1 0\n101102 1 0\n102103 1 0\n103104 2 0\n104105 1 0\n105106 1 0\n106107 1 0\n107108 1 0\n108109 1 0\n109110 1 0\n110111 1 0\n112111 1 6\n112113 1 0\n113114 1 0\n114115 1 0\n115116 1 0\n116117 1 0\n112118 1 0\n118119 1 0\n119120 1 0\n119121 1 0\n121122 1 6\n122123 1 0\n123124 1 0\n124125 1 0\n125126 1 0\n126127 1 0\n126128 2 0\n121129 1 0\n129130 1 0\n131130 1 1\n131132 1 0\n132133 1 0\n133134 2 0\n134135 1 0\n135136 2 0\n136137 1 0\n137138 2 0\n138133 1 0\n131139 1 0\n139140 1 0\n141140 1 6\n141142 1 0\n142143 1 0\n143144 2 0\n144145 1 0\n145146 2 0\n146147 1 0\n146148 1 0\n148149 2 0\n149143 1 0\n141150 1 0\n150151 1 0\n152151 1 1\n152153 1 0\n153154 1 0\n153155 1 0\n152156 1 0\n156157 1 0\n158157 1 6\n158159 1 0\n159160 1 0\n159161 1 0\n158162 1 0\n162163 1 0\n164163 1 1\n164165 1 0\n165166 1 0\n166167 1 0\n167168 1 0\n164169 1 0\n169170 1 0\n171170 1 1\n171172 1 0\n172173 1 0\n173174 2 0\n174175 1 0\n175176 1 0\n176177 2 0\n177173 1 0\n177178 1 0\n178179 2 0\n179180 1 0\n180181 2 0\n181176 1 0\n171182 1 0\n182183 1 0\n184183 1 6\n184185 1 0\n185186 1 0\n186187 1 0\n187188 1 0\n188189 1 0\n184190 1 0\n190191 1 0\n192191 1 6\n192193 1 0\n193194 1 0\n194195 1 0\n195196 1 0\n196197 1 0\n192198 1 0\n198199 1 0\n198200 2 0\n190201 2 0\n182202 2 0\n169203 2 0\n162204 2 0\n156205 2 0\n150206 2 0\n139207 2 0\n129208 2 0\n118209 2 0\n110210 2 0\n105211 1 0\n211212 2 0\n212103 1 0\n101213 1 0\n213214 1 0\n214215 2 0\n215216 1 0\n216217 1 0\n217218 1 0\n218219 1 0\n219220 1 0\n220221 1 0\n221222 1 0\n223222 1 1\n223224 1 0\n224225 1 0\n225226 1 0\n226227 1 0\n227228 1 0\n223229 1 0\n229230 1 0\n230231 1 0\n230232 1 0\n232233 1 1\n233234 1 0\n234235 1 0\n235236 1 0\n236237 1 0\n237238 1 0\n237239 2 0\n232240 1 0\n240241 1 0\n242241 1 6\n242243 1 0\n243244 1 0\n244245 2 0\n245246 1 0\n246247 2 0\n247248 1 0\n248249 2 0\n249244 1 0\n242250 1 0\n250251 1 0\n252251 1 1\n252253 1 0\n253254 1 0\n254255 2 0\n255256 1 0\n256257 2 0\n257258 1 0\n257259 1 0\n259260 2 0\n260254 1 0\n252261 1 0\n261262 1 0\n263262 1 6\n263264 1 0\n264265 1 0\n264266 1 0\n263267 1 0\n267268 1 0\n269268 1 1\n269270 1 0\n270271 1 0\n270272 1 0\n269273 1 0\n273274 1 0\n275274 1 6\n275276 1 0\n276277 1 0\n277278 1 0\n278279 1 0\n275280 1 0\n280281 1 0\n282281 1 6\n282283 1 0\n283284 1 0\n284285 2 0\n285286 1 0\n286287 1 0\n287288 2 0\n288284 1 0\n288289 1 0\n289290 2 0\n290291 1 0\n291292 2 0\n292287 1 0\n282293 1 0\n293294 1 0\n295294 1 1\n295296 1 0\n296297 1 0\n297298 1 0\n298299 1 0\n299300 1 0\n295301 1 0\n301302 1 0\n303302 1 1\n303304 1 0\n304305 1 0\n305306 1 0\n306307 1 0\n307308 1 0\n303309 1 0\n309310 1 0\n309311 2 0\n301312 2 0\n293313 2 0\n280314 2 0\n273315 2 0\n267316 2 0\n261317 2 0\n250318 2 0\n240319 2 0\n229320 2 0\n221321 2 0\n216322 1 0\n322323 2 0\n323214 1 0\n 99324 1 0\n324325 2 0\n325 97 1 0\n 92326 2 0\n 84327 2 0\n 73328 2 0\n 63329 2 0\n 52330 2 0\n 46331 2 0\n 40332 2 0\n 33333 2 0\nM END\n> \nCHEMBL4522427\n\n> \nNone","standard_inchi":"InChI=1S/C234H359N61O38/c1-19-22-76-172(204(303)257-158(130-155-133-253-168-79-37-34-73-165(155)168)136-256-171(82-40-52-109-235)203(302)266-180(229(328)329)88-46-58-115-241)263-220(319)197(143(4)5)280-223(322)200(146(10)11)277-214(313)186(127-152-97-103-162(296)104-98-152)269-209(308)183(124-149-67-28-25-29-68-149)274-217(316)191(91-64-118-250-232(244)245)289(16)226(325)177(85-43-55-112-238)258-194(299)94-49-61-121-293-140-159(283-286-293)137-292(138-160-141-294(287-284-160)122-62-50-95-195(300)259-178(86-44-56-113-239)227(326)290(17)192(92-65-119-251-233(246)247)218(317)275-184(125-150-69-30-26-31-70-150)210(309)270-187(128-153-99-105-163(297)106-100-153)215(314)278-201(147(12)13)224(323)281-198(144(6)7)221(320)264-173(77-23-20-2)207(306)272-189(131-156-134-254-169-80-38-35-74-166(156)169)212(311)261-175(83-41-53-110-236)205(304)267-181(230(330)331)89-47-59-116-242)139-161-142-295(288-285-161)123-63-51-96-196(301)260-179(87-45-57-114-240)228(327)291(18)193(93-66-120-252-234(248)249)219(318)276-185(126-151-71-32-27-33-72-151)211(310)271-188(129-154-101-107-164(298)108-102-154)216(315)279-202(148(14)15)225(324)282-199(145(8)9)222(321)265-174(78-24-21-3)208(307)273-190(132-157-135-255-170-81-39-36-75-167(157)170)213(312)262-176(84-42-54-111-237)206(305)268-182(231(332)333)90-48-60-117-243/h25-39,67-75,79-81,97-108,133-135,140-148,158,171-193,197-202,253-256,296-298H,19-24,40-66,76-78,82-96,109-132,136-139,235-243H2,1-18H3,(H,257,303)(H,258,299)(H,259,300)(H,260,301)(H,261,311)(H,262,312)(H,263,319)(H,264,320)(H,265,321)(H,266,302)(H,267,304)(H,268,305)(H,269,308)(H,270,309)(H,271,310)(H,272,306)(H,273,307)(H,274,316)(H,275,317)(H,276,318)(H,277,313)(H,278,314)(H,279,315)(H,280,322)(H,281,323)(H,282,324)(H,328,329)(H,330,331)(H,332,333)(H4,244,245,250)(H4,246,247,251)(H4,248,249,252)/t158-,171-,172-,173-,174-,175-,176-,177+,178+,179+,180+,181+,182+,183-,184-,185-,186-,187-,188-,189-,190-,191-,192-,193-,197-,198-,199-,200-,201-,202-/m0/s1","standard_inchi_key":"BFKUAGFDBTUEHS-MCZOLVINSA-N"},"molecule_synonyms":[],"molecule_type":"Unknown","natural_product":0,"oral":false,"orphan":-1,"parenteral":false,"polymer_flag":0,"pref_name":null,"prodrug":-1,"structure_type":"MOL","therapeutic_flag":false,"topical":false,"usan_stem":null,"usan_stem_definition":null,"usan_substem":null,"usan_year":null,"veterinary":-1,"withdrawn_flag":false}