@MOLECULE (5r,6s,7s)-6-hydroxy-13,14-dimethoxy-6,7-dimethyl-5,6,7,8-tetrahydro[1,3]benzodioxolo[5',6':3,4]cycloocta[1,2-f][1,3]benzodioxol-5-yl (2z)-2-methyl-2-butenoate 37 42 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 O 2.6299 -3.0475 -1.0889 O.3 1 UNL1 -0.3287 2 O 0.8129 -1.7837 1.6556 O.2 1 UNL1 -0.3946 3 O 4.1060 1.6842 -1.3668 O.3 1 UNL1 -0.3459 4 O 2.4422 3.0058 -2.0211 O.3 1 UNL1 -0.3192 5 O -0.4390 2.3603 -1.6626 O.3 1 UNL1 -0.1571 6 O -1.1413 2.7014 1.0517 O.2 1 UNL1 -0.4661 7 O -5.2366 -0.6593 -0.1028 O.2 1 UNL1 -0.3245 8 O -4.5097 1.3908 -0.5841 O.3 1 UNL1 -0.3551 9 O -1.1419 -0.5073 3.0132 O.2 2 UNL2 -0.2224 10 C 1.4364 -3.0921 -0.2148 C.3 1 UNL1 -0.1348 11 C 0.2003 -3.5668 -0.8417 C.2 1 UNL1 -0.4426 12 C 1.1713 -1.8018 0.5084 C.2 1 UNL1 0.4776 13 C -0.8423 -2.6729 -0.7813 C.1 1 UNL1 -0.0412 14 C 1.3664 -0.5664 -0.2969 C.ar 1 UNL1 -0.1114 15 C -1.5836 -1.5593 -0.6036 C.2 1 UNL1 -0.0474 16 C 2.7465 -3.8609 -0.0819 C.3 1 UNL1 0.4339 17 C 0.2808 0.1852 -0.7913 C.ar 1 UNL1 -0.0682 18 C 0.0253 -4.7719 -1.4150 C.3 1 UNL1 0.5054 19 C -1.1185 -0.2022 -0.7493 C.3 1 UNL1 0.0392 20 C 2.7072 -0.1821 -0.4459 C.ar 1 UNL1 -0.1706 21 C 0.5613 1.4670 -1.3391 C.ar 1 UNL1 0.1066 22 C -2.9523 -1.7093 -0.3386 C.2 1 UNL1 0.0933 23 C -2.0776 0.8501 -0.8740 C.2 1 UNL1 -0.2728 24 C 2.9280 1.0216 -1.0751 C.ar 1 UNL1 0.1342 25 C 1.8708 1.8563 -1.4981 C.ar 1 UNL1 0.0474 26 C -3.8704 -0.7480 -0.3055 C.2 1 UNL1 -0.0044 27 C -3.3970 0.5803 -0.6111 C.3 1 UNL1 0.2005 28 C -0.1149 0.0217 3.0316 C.1 2 UNL2 0.6225 29 C 3.7851 2.8739 -1.9368 C.3 1 UNL1 0.4736 30 C -5.5962 0.6304 -0.2745 C.3 1 UNL1 0.4853 31 C 0.9863 0.7224 3.0937 C.2 2 UNL2 -0.5753 32 C -1.6665 2.1614 -1.3889 C.2 1 UNL1 0.3259 33 C -1.5044 2.9886 2.0941 C.2 1 UNL1 0.4691 34 C 1.7758 1.8607 3.4041 C.3 2 UNL2 0.4933 35 C 2.4112 0.6620 2.8128 C.2 2 UNL2 -0.7171 36 C 3.4746 0.0654 2.3980 C.2 2 UNL2 0.3918 37 H 3.5334 -0.7901 -0.0730 H 1 UNL1 0.1999 @BOND 1 4 29 1 2 4 25 1 3 29 3 1 4 5 32 1 5 5 21 1 6 25 21 ar 7 25 24 ar 8 18 11 1 9 32 23 2 10 3 24 1 11 21 17 ar 12 1 10 1 13 1 16 1 14 24 20 ar 15 23 19 1 16 23 27 1 17 11 13 2 18 11 10 1 19 17 19 1 20 17 14 ar 21 13 15 2 22 19 15 1 23 27 8 1 24 27 26 1 25 15 22 1 26 8 30 1 27 20 14 ar 28 20 37 1 29 22 26 2 30 26 7 1 31 14 12 1 32 30 7 1 33 10 16 1 34 10 12 1 35 12 2 2 36 6 33 2 37 36 35 2 38 35 31 1 39 35 34 1 40 9 28 2 41 28 31 2 42 31 34 1