@MOLECULE (1'r,2s,3'r,6'r,8'r,12's,14'r,15'r,18'r,19'z,21'z,25'r,26's)-6',15'-dihydroxy-18'-[(1r)-1-hydroxyethyl]-5',14',26'-trimethyl-11'h,23'h-spiro[oxirane-2,27'-[2,10,13,17,24]pentaoxapentacyclo[23.2.1.0~3,8~.0~8,26~.0~12,14~]octacosa[4,19,21]triene]-11',23'-dione 44 51 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 O 0.4268 -0.2320 2.1075 O.3 1 UNL1 -0.2737 2 O 1.5174 -1.8235 -1.0585 O.3 1 UNL1 0.0840 3 O -3.0353 -1.8634 -0.1354 O.3 1 UNL1 -0.3291 4 O 2.4017 1.7429 -0.9484 O.3 1 UNL1 -0.5497 5 O 6.3900 -1.2398 1.3495 O.2 1 UNL1 -0.3939 6 O 0.8424 4.1205 0.1936 O.2 1 UNL1 0.2352 7 O -3.2286 -2.9855 -2.1140 O.2 1 UNL1 -0.3149 8 O 2.0514 2.9268 -2.8595 O.2 1 UNL1 -0.3288 9 O -0.2935 2.2258 -1.2926 O.2 1 UNL1 -0.4753 10 O -2.6059 1.0791 0.3366 O.2 1 UNL1 -0.3181 11 O -3.8035 0.0127 2.7845 O.2 1 UNL1 -0.2574 12 C 2.6364 -0.1509 1.0098 C.3 1 UNL1 -0.2214 13 C 1.4042 -0.8696 1.1940 C.3 1 UNL1 -0.1962 14 C 3.2502 -0.2603 -0.3742 C.3 1 UNL1 -0.2168 15 C 0.8149 -1.4576 -0.0076 C.3 1 UNL1 0.3697 16 C -1.7602 -1.7911 -0.2066 C.1 1 UNL1 0.3606 17 C 0.9182 -1.2806 2.6583 C.3 1 UNL1 0.5502 18 C -0.5511 -1.6578 -0.1103 C.1 1 UNL1 -0.3417 19 C 2.8787 -1.5742 -0.9446 C.3 1 UNL1 -0.2211 20 C 3.7009 0.5226 1.7539 C.3 1 UNL1 0.2412 21 C 4.2897 -0.3394 0.7428 C.3 1 UNL1 -0.2225 22 C 3.2929 0.8598 -1.3969 C.3 1 UNL1 0.5079 23 C 5.3913 -1.3673 0.6909 C.2 1 UNL1 0.5338 24 C 3.7966 -2.5647 -0.8754 C.2 1 UNL1 -0.1042 25 C 5.0112 -2.4362 -0.1771 C.2 1 UNL1 -0.5214 26 C 4.8007 -3.6634 -0.7969 C.3 1 UNL1 0.2904 27 C -3.7851 -2.5203 -1.1802 C.2 1 UNL1 0.5958 28 C 2.0006 2.8497 -1.6739 C.2 1 UNL1 0.6088 29 C 1.5778 3.8479 -0.6911 C.3 1 UNL1 0.0729 30 C -0.2997 3.2962 0.7618 C.2 1 UNL1 -0.7995 31 C -5.1704 -2.4489 -0.7274 C.2 1 UNL1 -0.2969 32 C -0.8993 2.5138 -0.2722 C.2 1 UNL1 0.3702 33 C -0.4278 3.4978 2.0479 C.2 1 UNL1 0.4752 34 C -5.9265 -1.3495 -0.8163 C.2 1 UNL1 -0.0110 35 C -2.3685 2.2348 -0.2157 C.3 1 UNL1 0.2186 36 C -5.5127 -0.0874 -1.4218 C.2 1 UNL1 -0.1618 37 C -3.9527 0.6636 0.3574 C.2 1 UNL1 0.2483 38 C -4.6553 0.8010 -0.9078 C.2 1 UNL1 -0.1374 39 C -4.3841 0.1582 1.4949 C.2 1 UNL1 -0.2793 40 C -5.0306 -0.4620 2.6513 C.3 1 UNL1 0.4468 41 H -5.5420 -3.3873 -0.3002 H 1 UNL1 0.2006 42 H -6.9684 -1.3580 -0.4600 H 1 UNL1 0.1734 43 H -5.9969 0.1077 -2.3910 H 1 UNL1 0.1821 44 H -4.4122 1.7308 -1.4556 H 1 UNL1 0.2063 @BOND 1 8 28 2 2 43 36 1 3 7 27 2 4 28 4 1 5 28 29 1 6 44 38 1 7 36 38 2 8 36 34 1 9 22 4 1 10 22 14 1 11 9 32 2 12 27 31 1 13 27 3 1 14 2 19 1 15 2 15 1 16 19 24 1 17 19 14 1 18 38 37 1 19 24 26 1 20 24 25 2 21 34 31 2 22 34 42 1 23 26 25 1 24 31 41 1 25 29 6 1 26 14 21 1 27 14 12 1 28 32 35 1 29 32 30 1 30 35 10 1 31 16 3 1 32 16 18 3 33 25 23 1 34 18 15 1 35 15 13 1 36 6 30 1 37 10 37 1 38 37 39 2 39 23 21 1 40 23 5 2 41 21 12 1 42 21 20 1 43 30 33 2 44 12 13 1 45 12 20 1 46 13 1 1 47 13 17 1 48 39 40 1 49 39 11 1 50 1 17 1 51 40 11 1