@MOLECULE (10r,11s,12s)-12-hydroxy-6,6,10,11-tetramethyl-4-propyl-7,8,11,12-tetrahydro-2h,6h,10h-dipyrano[2,3-f:2',3'-h]chromen-2-one 55 58 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 O -2.2918 -1.9475 0.1364 O.3 1 UNL1 -0.3444 2 O 2.2882 -0.9926 -0.3436 O.3 1 UNL1 -0.3537 3 O -3.2886 1.7901 -0.9014 O.3 1 UNL1 -0.5643 4 O -0.8472 2.5412 0.0337 O.2 1 UNL1 -0.4147 5 O -0.3303 4.6517 0.0769 O.2 1 UNL1 -0.4289 6 C -4.0493 -0.2552 -0.0923 C.3 1 UNL1 -0.1740 7 C -3.0210 0.8764 0.1458 C.3 1 UNL1 0.2066 8 C -1.6138 0.3684 0.0666 C.ar 1 UNL1 -0.3910 9 C -0.0466 -1.5078 -0.1500 C.ar 1 UNL1 -0.3136 10 C 2.6055 -2.3958 -0.1753 C.3 1 UNL1 0.3180 11 C -1.3477 -1.0005 0.0227 C.ar 1 UNL1 0.3764 12 C -3.5880 -1.5272 0.6205 C.3 1 UNL1 0.1283 13 C 0.1642 -2.9758 -0.2676 C.3 1 UNL1 -0.2162 14 C 1.5460 -3.2596 -0.8631 C.3 1 UNL1 -0.3352 15 C 1.0118 -0.6027 -0.2189 C.ar 1 UNL1 0.3840 16 C 0.8127 0.8031 -0.1676 C.ar 1 UNL1 -0.3697 17 C -0.5230 1.2396 -0.0257 C.ar 1 UNL1 0.4098 18 C -5.4216 0.1844 0.4095 C.3 1 UNL1 -0.4426 19 C 3.9588 -2.5070 -0.8792 C.3 1 UNL1 -0.4883 20 C 2.7222 -2.6465 1.3234 C.3 1 UNL1 -0.4984 21 C 1.8390 1.8043 -0.2607 C.ar 1 UNL1 0.2601 22 C -4.4492 -2.7475 0.3210 C.3 1 UNL1 -0.4715 23 C 3.2827 1.4509 -0.4369 C.3 1 UNL1 -0.3073 24 C 1.4982 3.1196 -0.1863 C.ar 1 UNL1 -0.4610 25 C 0.1450 3.5561 -0.0212 C.ar 1 UNL1 0.6319 26 C 3.9067 1.1415 0.9344 C.3 1 UNL1 -0.2313 27 C 5.4086 0.8981 0.8029 C.3 1 UNL1 -0.4407 28 H -4.0964 -0.4384 -1.1977 H 1 UNL1 0.1768 29 H -3.1998 1.4129 1.1082 H 1 UNL1 0.1308 30 H -3.4643 -1.3653 1.7141 H 1 UNL1 0.1318 31 H 0.0390 -3.4628 0.7166 H 1 UNL1 0.1471 32 H -0.6194 -3.4315 -0.9140 H 1 UNL1 0.1579 33 H 1.8028 -4.3296 -0.7741 H 1 UNL1 0.1500 34 H 1.5364 -3.0317 -1.9494 H 1 UNL1 0.1610 35 H -5.4427 0.3253 1.4958 H 1 UNL1 0.1421 36 H -5.7019 1.1458 -0.0499 H 1 UNL1 0.1713 37 H -6.2019 -0.5372 0.1472 H 1 UNL1 0.1409 38 H 3.8780 -2.2835 -1.9500 H 1 UNL1 0.1623 39 H 4.6805 -1.7972 -0.4545 H 1 UNL1 0.1630 40 H 4.3755 -3.5153 -0.7720 H 1 UNL1 0.1580 41 H 2.9523 -3.6951 1.5350 H 1 UNL1 0.1565 42 H 3.5135 -2.0278 1.7663 H 1 UNL1 0.1599 43 H 1.7909 -2.3948 1.8475 H 1 UNL1 0.1693 44 H -4.5953 -2.8848 -0.7582 H 1 UNL1 0.1629 45 H -3.9773 -3.6646 0.7001 H 1 UNL1 0.1595 46 H -5.4356 -2.6605 0.7891 H 1 UNL1 0.1580 47 H -2.5998 2.4822 -0.9296 H 1 UNL1 0.3382 48 H 3.4138 0.5919 -1.1282 H 1 UNL1 0.1722 49 H 3.8360 2.2833 -0.9203 H 1 UNL1 0.1558 50 H 2.2410 3.9133 -0.2485 H 1 UNL1 0.1941 51 H 3.7173 1.9802 1.6328 H 1 UNL1 0.1425 52 H 3.4113 0.2562 1.3802 H 1 UNL1 0.1461 53 H 5.9301 1.7930 0.4437 H 1 UNL1 0.1448 54 H 5.6271 0.0874 0.0998 H 1 UNL1 0.1384 55 H 5.8510 0.6268 1.7678 H 1 UNL1 0.1406 @BOND 1 38 19 1 2 34 14 1 3 28 6 1 4 48 23 1 5 47 3 1 6 49 23 1 7 32 13 1 8 3 7 1 9 19 40 1 10 19 39 1 11 19 10 1 12 14 33 1 13 14 13 1 14 14 10 1 15 44 22 1 16 23 21 1 17 23 26 1 18 2 15 1 19 2 10 1 20 13 9 1 21 13 31 1 22 21 24 ar 23 21 16 ar 24 50 24 1 25 15 16 ar 26 15 9 ar 27 24 25 ar 28 10 20 1 29 16 17 ar 30 9 11 ar 31 6 7 1 32 6 18 1 33 6 12 1 34 36 18 1 35 17 4 ar 36 17 8 ar 37 25 4 ar 38 25 5 2 39 11 8 ar 40 11 1 1 41 8 7 1 42 54 27 1 43 1 12 1 44 7 29 1 45 37 18 1 46 22 12 1 47 22 45 1 48 22 46 1 49 18 35 1 50 53 27 1 51 12 30 1 52 27 26 1 53 27 55 1 54 26 52 1 55 26 51 1 56 20 41 1 57 20 42 1 58 20 43 1