@MOLECULE (1r,2r,3r)-2,6,7-trihydroxy-3-methyl-4,11-dioxo-2,3,4,11-tetrahydro-1h-benzo[a]fluoren-1-yl 2-methylpropanoate 49 52 0 0 0 SMALL GASTEIGER @ATOM 1 O -1.9930 0.7736 -0.3018 O.3 1 UNL1111111111 -0.4341 2 O -2.5904 -1.5936 2.3912 O.3 1 UNL1111111111 -0.5512 3 O -1.7125 -4.0534 -0.3510 O.2 1 UNL1111111111 -0.4537 4 O 3.0774 -2.6433 -0.9077 O.3 1 UNL1111111111 -0.4122 5 O 0.3601 2.1181 1.2233 O.2 1 UNL1111111111 -0.3987 6 O 4.9382 -0.9489 -0.8188 O.3 1 UNL1111111111 -0.4152 7 O -3.3614 2.0148 0.9752 O.2 1 UNL1111111111 -0.5116 8 C -1.6570 -0.0480 0.8211 C.3 1 UNL1111111111 0.0702 9 C -2.8474 -0.9772 1.1427 C.3 1 UNL1111111111 0.1085 10 C -3.0210 -2.1495 0.1718 C.3 1 UNL1111111111 -0.2113 11 C -0.4179 -0.7610 0.3708 C.ar 1 UNL1111111111 0.0223 12 C -0.4491 -2.1004 -0.0588 C.ar 1 UNL1111111111 -0.0938 13 C 0.7940 -0.1022 0.3510 C.ar 1 UNL1111111111 -0.1396 14 C -1.7188 -2.8749 -0.0868 C.2 1 UNL1111111111 0.4829 15 C 1.9953 -0.7185 -0.0936 C.ar 1 UNL1111111111 -0.0285 16 C -3.5867 -1.6789 -1.1665 C.3 1 UNL1111111111 -0.4403 17 C 0.7098 -2.7383 -0.4747 C.ar 1 UNL1111111111 -0.2005 18 C 3.0855 0.2526 -0.0140 C.ar 1 UNL1111111111 -0.0835 19 C 1.1078 1.3031 0.7615 C.2 1 UNL1111111111 0.4731 20 C 1.9359 -2.0466 -0.4972 C.ar 1 UNL1111111111 0.2455 21 C 2.5707 1.4750 0.4952 C.ar 1 UNL1111111111 -0.1054 22 C 4.4372 0.2059 -0.3282 C.ar 1 UNL1111111111 0.2777 23 C -2.8105 1.8377 -0.0785 C.2 1 UNL1111111111 0.6054 24 C 3.3476 2.5921 0.6870 C.ar 1 UNL1111111111 -0.1472 25 C -2.8986 2.6562 -1.3453 C.3 1 UNL1111111111 -0.1326 26 C 5.2544 1.3416 -0.1393 C.ar 1 UNL1111111111 -0.2700 27 C 4.7134 2.5141 0.3599 C.ar 1 UNL1111111111 -0.0901 28 C -4.2859 2.4400 -1.9504 C.3 1 UNL1111111111 -0.4445 29 C -2.6565 4.1188 -0.9767 C.3 1 UNL1111111111 -0.4441 30 H -1.4454 0.6165 1.7000 H 1 UNL1111111111 0.1750 31 H -3.7882 -0.3820 1.2158 H 1 UNL1111111111 0.1460 32 H -3.7334 -2.8824 0.6439 H 1 UNL1111111111 0.1878 33 H -2.9295 -0.9405 -1.6480 H 1 UNL1111111111 0.1651 34 H -4.5724 -1.2153 -1.0440 H 1 UNL1111111111 0.1503 35 H -3.7068 -2.5192 -1.8636 H 1 UNL1111111111 0.1585 36 H 0.6666 -3.7852 -0.7876 H 1 UNL1111111111 0.1846 37 H -2.6422 -0.9405 3.1187 H 1 UNL1111111111 0.3237 38 H 2.9192 3.5116 1.0825 H 1 UNL1111111111 0.1718 39 H -2.1152 2.3192 -2.0736 H 1 UNL1111111111 0.1705 40 H 6.3106 1.2868 -0.3892 H 1 UNL1111111111 0.1596 41 H 5.3469 3.3893 0.5038 H 1 UNL1111111111 0.1539 42 H 2.9227 -3.5915 -1.1587 H 1 UNL1111111111 0.3190 43 H -1.6564 4.2667 -0.5465 H 1 UNL1111111111 0.1597 44 H -2.7394 4.7702 -1.8535 H 1 UNL1111111111 0.1507 45 H -3.3825 4.4710 -0.2299 H 1 UNL1111111111 0.1641 46 H -4.4229 3.0536 -2.8491 H 1 UNL1111111111 0.1545 47 H -4.4432 1.3937 -2.2396 H 1 UNL1111111111 0.1500 48 H -5.0821 2.7149 -1.2450 H 1 UNL1111111111 0.1609 49 H 5.9095 -0.8821 -1.0041 H 1 UNL1111111111 0.3164 @BOND 1 1 8 1 2 1 23 1 3 2 9 1 4 2 37 1 5 3 14 2 6 4 20 1 7 4 42 1 8 5 19 2 9 6 22 1 10 6 49 1 11 7 23 2 12 8 9 1 13 8 11 1 14 8 30 1 15 9 10 1 16 9 31 1 17 10 14 1 18 10 16 1 19 10 32 1 20 11 12 ar 21 11 13 ar 22 12 14 1 23 12 17 ar 24 13 15 ar 25 13 19 1 26 15 18 1 27 15 20 ar 28 16 33 1 29 16 34 1 30 16 35 1 31 17 20 ar 32 17 36 1 33 18 21 ar 34 18 22 ar 35 19 21 1 36 21 24 ar 37 22 26 ar 38 23 25 1 39 24 27 ar 40 24 38 1 41 25 28 1 42 25 29 1 43 25 39 1 44 26 27 ar 45 26 40 1 46 27 41 1 47 28 46 1 48 28 47 1 49 28 48 1 50 29 43 1 51 29 44 1 52 29 45 1