@MOLECULE 15-hydroxy-11,18,21-trimethyl-5,17,24,28,29-pentaoxanonacyclo[17.9.1.1~1,20~.0~2,12~.0~4,6~.0~6,11~.0~15,19~.0~18,23~.0~21,26~]triacont-8-ene-10,16,25,30-tetrone 38 46 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 C 1.6759 0.6730 -1.1272 C.3 1 UNL1 0.1058 2 C -0.2337 -1.0356 0.0476 C.3 1 UNL1 0.2890 3 C -3.9793 -0.7030 0.1083 C.3 1 UNL1 -0.0853 4 C 1.5710 2.1056 -0.7668 C.3 1 UNL1 -0.0165 5 C 1.0705 1.5309 -2.0609 C.2 1 UNL1 -0.6337 6 C 2.3574 -0.3157 -0.5658 C.3 1 UNL1 -0.0562 7 C -3.5497 0.5964 -0.0297 C.3 1 UNL1 -0.0588 8 C 3.6918 -2.0741 0.0382 C.3 1 UNL1 -0.0409 9 O -5.8617 -2.1077 0.6546 O.2 1 UNL1 -0.3794 10 C 1.2928 -2.6242 -0.5418 C.2 1 UNL1 -0.1139 11 C -2.7960 -1.5245 -0.0498 C.2 1 UNL1 -0.2979 12 O 0.0044 -2.1059 -0.7174 O.2 1 UNL1 -0.3129 13 C -1.6248 -0.6312 -0.0873 C.2 1 UNL1 -0.1480 14 O 2.7715 2.8984 -0.6469 O.2 1 UNL1 -0.1134 15 C 4.3337 -1.0409 0.5933 C.2 1 UNL1 -0.1877 16 C 0.5533 2.4912 0.2505 C.2 1 UNL1 0.5813 17 C -2.0874 0.6651 -0.0391 C.2 1 UNL1 -0.0336 18 C 4.1461 1.2772 0.4938 C.2 1 UNL1 -0.0155 19 C 5.5473 -0.4390 1.1263 C.2 1 UNL1 0.5800 20 O -2.7623 -4.0044 -0.2204 O.2 1 UNL1 -0.1479 21 O 5.3656 1.0097 1.0772 O.3 1 UNL1 -0.2980 22 C 3.4475 0.1359 0.3054 C.2 1 UNL1 -0.0755 23 C -2.7824 -2.8589 -0.1347 C.1 1 UNL1 0.5711 24 C -4.1756 1.9028 0.4306 C.3 1 UNL1 0.0637 25 C 1.3525 -3.9656 -0.4210 C.1 1 UNL1 0.4875 26 C 0.4728 1.8138 -3.1971 C.2 1 UNL1 0.5835 27 C -1.7654 2.0966 0.0420 C.3 1 UNL1 0.1759 28 O 1.4245 -5.1123 -0.3843 O.2 1 UNL1 -0.1175 29 O -0.6571 2.6698 -0.4296 O.3 1 UNL1 -0.3702 30 O 6.5710 -0.8261 1.5882 O.2 1 UNL1 -0.3564 31 C -5.3419 1.4140 1.0690 C.2 1 UNL1 0.0237 32 C -5.3633 -1.0198 0.6456 C.2 1 UNL1 0.5209 33 C -5.8030 0.2690 1.1196 C.2 1 UNL1 -0.1815 34 O 0.6644 2.6555 1.4213 O.2 1 UNL1 -0.3400 35 O -4.0175 3.2163 -0.2058 O.3 1 UNL1 -0.1224 36 C 3.8301 2.5820 -0.0692 C.2 1 UNL1 0.2839 37 C 2.4162 -1.7848 -0.4434 C.3 1 UNL1 0.1393 38 C -2.9220 2.7371 0.4171 C.3 1 UNL1 0.0974 @BOND 1 26 5 2 2 5 1 1 3 5 4 1 4 1 4 1 5 1 6 1 6 4 14 1 7 4 16 1 8 12 10 1 9 12 2 1 10 14 36 1 11 6 37 1 12 6 22 1 13 10 37 1 14 10 25 2 15 37 8 1 16 29 27 1 17 29 16 1 18 25 28 2 19 20 23 2 20 35 38 1 21 35 24 1 22 23 11 2 23 13 11 1 24 13 17 2 25 13 2 1 26 36 18 2 27 11 3 1 28 17 7 1 29 17 27 1 30 7 3 1 31 7 24 1 32 8 15 1 33 27 38 1 34 3 32 1 35 16 34 2 36 22 18 1 37 22 15 2 38 38 24 1 39 24 31 1 40 18 21 1 41 15 19 1 42 32 9 2 43 32 33 1 44 31 33 2 45 21 19 1 46 19 30 2