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0 3 0 0 0 0 0 0 0 0 0 14.5365 1.1526 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 14.7609 2.1833 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 11.1477 1.8595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5419 1.4734 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0354 -2.0461 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6617 0.4890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9178 1.4958 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0594 1.7388 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5300 3.1080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6550 0.5731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0357 -0.0457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7677 -1.0457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0049 3.2852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1743 3.3227 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.0617 1.4359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9017 0.4543 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7677 -0.0457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1037 -1.9474 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1042 1.7677 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5146 2.9282 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3039 0.7203 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0197 2.0236 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5677 -0.0249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9178 -2.5872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1257 -1.5525 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3373 -6.8523 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8288 -1.5428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3444 1.0467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7518 -2.9167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5677 -1.0665 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1176 1.5028 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8674 -1.2392 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5194 3.2354 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8376 3.2068 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5791 -0.4712 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1257 0.4612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6617 -1.5803 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9058 -2.6943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5389 -0.3409 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2268 -4.6200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5561 3.0114 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0840 -3.7265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6242 -0.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5403 -5.4654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9180 0.1108 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5031 -4.0353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4834 -6.2605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1176 -2.5941 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0197 -3.1149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5675 -2.3754 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5378 -5.1392 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4233 -1.8284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3013 -4.4226 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6854 2.7026 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6090 0.9722 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5400 -3.3908 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2970 -4.1251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4940 -5.2216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0867 -2.6178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3183 -3.6333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6275 -4.6337 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2147 2.2133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.8462 0.5209 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0354 -2.0461 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5354 -2.9122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1584 -1.7438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9445 3.3569 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7658 1.2895 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 12.4300 -3.7495 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.4474 3.9132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8557 -2.5608 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2888 2.8138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4891 -3.5704 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8397 -2.3826 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2470 4.8929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9837 2.0259 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0612 4.3934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.8646 2.7404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.4961 1.0480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7086 -3.1594 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3863 -3.2385 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9753 -0.4913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2731 -5.3172 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4860 -3.1457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9954 5.5562 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2984 5.2092 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.1774 -1.4413 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4895 -5.9039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8528 -1.4624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7950 6.5360 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.4700 -2.9675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1614 -1.2632 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0981 6.1890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8464 6.8523 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.8077 -2.0262 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6072 -6.3277 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9208 -2.4389 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1766 -3.3838 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6407 -6.0737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6194 -3.1534 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6594 -6.5726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6105 -4.2612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6432 -6.1316 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0624 -4.0490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6822 -6.6292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7126 -6.4956 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2062 -5.0379 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7871 -6.1767 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9410 -5.6846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6918 -1.4279 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9384 -1.1642 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5637 3.3248 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0700 3.9640 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1493 1.3551 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7801 -4.2612 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8862 -4.0466 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6887 2.9697 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5563 1.7883 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2212 2.5986 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4110 2.2635 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5181 3.9743 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4803 4.8503 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6043 4.8125 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.3233 2.3232 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 18.2817 3.1991 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.4059 3.1575 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.9548 0.6308 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.9132 1.5067 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.0374 1.4651 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6009 -2.5488 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0980 -3.2671 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8162 -3.7700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4939 -3.8491 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9968 -3.1308 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2786 -2.6279 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5835 5.3601 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2767 -3.7293 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8345 4.7979 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7767 -0.9682 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3356 -1.1206 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4726 -1.4798 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4828 -6.5239 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1680 -5.3738 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2589 6.9472 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.8707 -3.4406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5099 6.3851 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3708 -0.6796 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7221 7.4598 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17.4178 -1.9158 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7023 -5.4568 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5967 -3.6032 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7554 -7.1851 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1252 -2.7948 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5106 -5.5259 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0842 -4.5888 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6578 -7.2488 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6544 -3.8647 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 75 1 0 0 0 0 1 96 1 0 0 0 0 2 74 1 0 0 0 0 2 97 1 0 0 0 0 3 74 2 0 0 0 0 4 75 2 0 0 0 0 5 82 1 0 0 0 0 5 98 1 0 0 0 0 6 83 1 0 0 0 0 6 99 1 0 0 0 0 7 84 1 0 0 0 0 7100 1 0 0 0 0 8 85 1 0 0 0 0 8101 1 0 0 0 0 9 89 1 0 0 0 0 9103 1 0 0 0 0 10 88 1 0 0 0 0 10102 1 0 0 0 0 11 83 2 0 0 0 0 12 82 2 0 0 0 0 13 84 2 0 0 0 0 14 85 2 0 0 0 0 15102 2 0 0 0 0 16103 2 0 0 0 0 17 18 1 0 0 0 0 17 23 1 0 0 0 0 17 28 1 0 0 0 0 17 29 1 0 0 0 0 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1 0 0 0 0 125176 1 0 0 0 0 126128 1 0 0 0 0 127129 1 0 0 0 0 128129 3 0 0 0 0 M END > 16151169 > 0 > 5420 > 16 > 0 > 14 > AAADcfB8PgAAAAAAAAAAAAAAGDAAAYMGDBgwYMGDBgwAAACBVAAAGgAAAAAADhSgmAIyCMAABADIEiDSCAgCAAAgAAAIiAEAAIgIJDaINRCCMAAl4AEIqAeIyPCPwAACAAAQAACAAAQAACAAAQAACAAAAA== > InChI=1S/C113H48O16/c1-122-95(116)111(96(117)123-2)105-83-55-47-45-46-49-53-51(47)79-67(83)63-75-59-61-77-65-69-81(53)103(79)41(29-39(31-101(75,77)103)37-13-9-7-10-14-37)128-43(114)27-35-23-19-33(20-24-35)17-18-34-21-25-36(26-22-34)28-44(115)129-42-30-40(38-15-11-8-12-16-38)32-102-76-60-62-78(102)66-70-82-54-50(46)58-57(49)85(69)107-93(65)73-74(94(66)108(107,86(58)70)112(107,97(118)124-3)98(119)125-4)90(62)110(89(61)73)109(113(110,99(120)126-5)100(121)127-6)87(59)71(91(63)105)72(88(60)109)92-64(76)68-80(104(42,82)102)52(54)48(45)56(55)84(68)106(92,105)111/h7-16,19-26,29-30,41-42H,27-28,31-32H2,1-6H3 > IRKBCSKBRRTOIK-UHFFFAOYSA-N > 15.3 > 1661.29759 > C113H48O16 > 1661.58062 > COC(=O)C1(C23C14C5=C6C7=C8C9=C1C%10=C7C7=C%11C%12=C%10C%10=C%13C%14=C%12C%12%15C%11=C(C2=C76)C2=C3C3=C6C7=C2C%122CC(=CC%15OC(=O)CC%11=CC=C(C=C%11)C#CC%11=CC=C(CC(=O)OC%12C=C(CC%15%16C%12%12C8=C5C5=C4C3=C3C64C6(C4(C(=O)OC)C(=O)OC)C4=C8C%17=C6C(=C%15C6=C%17C%15(C%13(C8=C%14C2=C74)C%15(C(=O)OC)C(=O)OC)C(=C1%10)C6=C%129)C3=C%165)C1=CC=CC=C1)C=C%11)C1=CC=CC=C1)C(=O)OC > COC(=O)C1(C23C14C5=C6C7=C8C9=C1C%10=C7C7=C%11C%12=C%10C%10=C%13C%14=C%12C%12%15C%11=C(C2=C76)C2=C3C3=C6C7=C2C%122CC(=CC%15OC(=O)CC%11=CC=C(C=C%11)C#CC%11=CC=C(CC(=O)OC%12C=C(CC%15%16C%12%12C8=C5C5=C4C3=C3C64C6(C4(C(=O)OC)C(=O)OC)C4=C8C%17=C6C(=C%15C6=C%17C%15(C%13(C8=C%14C2=C74)C%15(C(=O)OC)C(=O)OC)C(=C1%10)C6=C%129)C3=C%165)C1=CC=CC=C1)C=C%11)C1=CC=CC=C1)C(=O)OC > 210 > 1660.294235 > 0 > 129 > 0 > 6 > 0 > 0 > 0 > 1 > 1 > 1 5 255 > 104 111 8 105 110 8 106 113 8 107 112 8 110 114 8 111 115 8 112 115 8 113 114 8 116 119 8 116 121 8 117 118 8 117 120 8 118 122 8 119 123 8 120 124 8 121 125 8 122 127 8 123 126 8 124 127 8 125 126 8 19 25 3 20 25 3 21 24 3 22 24 3 26 37 8 26 43 8 27 36 8 27 42 8 28 35 8 28 41 8 29 34 8 29 40 8 30 35 8 30 55 8 31 36 8 31 56 8 32 37 8 32 57 8 33 34 8 33 54 8 34 35 8 36 37 8 40 42 8 40 53 8 41 43 8 41 52 8 42 51 8 43 50 8 44 58 8 44 69 8 45 59 8 45 68 8 46 60 8 46 67 8 47 61 8 47 66 8 50 57 8 51 56 8 52 55 8 53 54 8 54 61 8 55 60 8 56 59 8 57 58 8 58 62 8 59 63 8 60 64 8 61 65 8 62 73 8 63 72 8 64 71 8 65 70 8 66 67 8 66 76 8 67 78 8 68 69 8 68 79 8 69 77 8 70 72 8 70 76 8 71 73 8 71 78 8 72 79 8 73 77 8 76 81 8 77 80 8 78 81 8 79 80 8 80 81 8 88 92 3 89 93 3 94 104 8 94 107 8 95 105 8 95 106 8 $$$$