@MOLECULE (6r,8s,11r,13s,14s,17r)-11-[4-(dimethylamino)phenyl]-6,13-dimethyl-1,4',5',6,7,8,11,12,13,14,15,16-dodecahydro-3'h-spiro[cyclopenta[a]phenanthrene-17,2'-furan]-3(2h)-one 72 77 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 C -0.7860 2.0583 0.7878 C.3 1 UNL1 -0.1413 2 C -1.8660 1.1878 0.0963 C.3 1 UNL1 0.0394 3 C 0.4295 1.2118 1.1719 C.3 1 UNL1 -0.1222 4 C -3.0413 2.2120 0.0102 C.3 1 UNL1 0.2584 5 C 0.0580 -0.0756 -1.0338 C.3 1 UNL1 -0.1158 6 C 2.8329 1.4894 1.9983 C.3 1 UNL1 -0.1146 7 C -1.0697 -2.2948 -1.3686 C.ar 1 UNL1 -0.1084 8 C 0.5727 -2.1344 0.3704 C.ar 1 UNL1 -0.1248 9 C -1.2877 -3.6301 -1.0533 C.ar 1 UNL1 -0.2625 10 C 0.3702 -3.4682 0.6969 C.ar 1 UNL1 -0.2428 11 C -2.3510 0.0033 0.9376 C.3 1 UNL1 -0.4477 12 C 2.8932 0.1567 2.7503 C.3 1 UNL1 -0.4388 13 C -1.8239 -6.3243 -0.3672 C.3 1 UNL1 -0.2631 14 C 0.2809 -6.3508 0.8673 C.3 1 UNL1 -0.2580 15 C -0.1540 -1.5206 -0.6517 C.ar 1 UNL1 -0.0552 16 C -0.5819 -4.2379 0.0005 C.ar 1 UNL1 0.2029 17 O 6.0153 1.9687 -1.6034 O.2 1 UNL1 -0.4768 18 C -1.2730 0.6966 -1.2230 C.3 1 UNL1 -0.2941 19 C -1.5443 2.7691 1.9204 C.3 1 UNL1 -0.2737 20 C -2.9636 2.9904 1.3565 C.3 1 UNL1 -0.3320 21 C 1.4176 2.0826 1.9664 C.3 1 UNL1 -0.2870 22 C -3.0665 3.1544 -1.2072 C.3 1 UNL1 -0.3250 23 C 2.9996 0.0126 -1.5208 C.3 1 UNL1 -0.2538 24 C -5.2304 2.1465 -0.8109 C.3 1 UNL1 -0.0334 25 C -4.5609 3.3386 -1.5089 C.3 1 UNL1 -0.3056 26 C 3.9416 0.9997 -2.2133 C.3 1 UNL1 -0.3749 27 C 4.9254 1.5980 -1.2331 C.2 1 UNL1 0.4939 28 O -4.2524 1.4742 -0.0263 O.3 1 UNL1 -0.4183 29 C 4.4880 1.7336 0.1626 C.2 1 UNL1 -0.3671 30 N -0.8825 -5.5424 0.4531 N.pl3 1 UNL1 -0.3847 31 C 1.0141 0.6189 -0.0879 C.2 1 UNL1 0.0272 32 C 2.3385 0.6511 -0.3342 C.2 1 UNL1 -0.1134 33 C 3.2830 1.3040 0.5756 C.2 1 UNL1 0.1166 34 H -0.4408 2.8371 0.0607 H 1 UNL1 0.1411 35 H 0.1036 0.3601 1.8268 H 1 UNL1 0.1641 36 H 0.5332 -0.0940 -2.0613 H 1 UNL1 0.1559 37 H -2.0139 0.0681 -1.7520 H 1 UNL1 0.1539 38 H -1.0733 1.5547 -1.8953 H 1 UNL1 0.1368 39 H -1.5721 2.1492 2.8314 H 1 UNL1 0.1427 40 H -1.0650 3.7177 2.2021 H 1 UNL1 0.1332 41 H -3.1884 4.0562 1.2223 H 1 UNL1 0.1375 42 H -3.7327 2.6011 2.0454 H 1 UNL1 0.1566 43 H 1.4645 3.0976 1.5233 H 1 UNL1 0.1464 44 H 1.0408 2.2204 2.9968 H 1 UNL1 0.1435 45 H -2.5576 4.1077 -1.0038 H 1 UNL1 0.1477 46 H -2.5509 2.7105 -2.0754 H 1 UNL1 0.1491 47 H -2.8070 0.3284 1.8784 H 1 UNL1 0.1487 48 H -3.1181 -0.5664 0.3946 H 1 UNL1 0.1615 49 H -1.5433 -0.6949 1.1806 H 1 UNL1 0.1558 50 H 3.5065 2.2150 2.5231 H 1 UNL1 0.1455 51 H 2.2667 -0.3798 -2.2549 H 1 UNL1 0.1497 52 H 3.5664 -0.8824 -1.1804 H 1 UNL1 0.1574 53 H -6.0336 2.4450 -0.1194 H 1 UNL1 0.1218 54 H -5.6037 1.3834 -1.5126 H 1 UNL1 0.1275 55 H -4.9342 4.2973 -1.1138 H 1 UNL1 0.1411 56 H -4.7611 3.3498 -2.5909 H 1 UNL1 0.1420 57 H 5.2056 2.2083 0.8273 H 1 UNL1 0.1754 58 H -1.6288 -1.8535 -2.1943 H 1 UNL1 0.1494 59 H 1.3204 -1.5685 0.9289 H 1 UNL1 0.1552 60 H 2.2493 -0.6015 2.2886 H 1 UNL1 0.1515 61 H 3.9136 -0.2444 2.7618 H 1 UNL1 0.1493 62 H 2.5690 0.2753 3.7897 H 1 UNL1 0.1460 63 H 4.4858 0.5086 -3.0441 H 1 UNL1 0.1693 64 H 3.3670 1.8259 -2.6810 H 1 UNL1 0.1695 65 H -2.0103 -4.1919 -1.6363 H 1 UNL1 0.1534 66 H 0.9406 -3.9074 1.5103 H 1 UNL1 0.1566 67 H -1.4587 -6.5398 -1.3832 H 1 UNL1 0.1281 68 H -2.0393 -7.2824 0.1364 H 1 UNL1 0.1479 69 H -2.7849 -5.7824 -0.4354 H 1 UNL1 0.1554 70 H 0.7446 -5.8954 1.7598 H 1 UNL1 0.1522 71 H -0.0476 -7.3605 1.1632 H 1 UNL1 0.1470 72 H 1.0468 -6.4493 0.0824 H 1 UNL1 0.1307 @BOND 1 63 26 1 2 64 26 1 3 56 25 1 4 51 23 1 5 26 23 1 6 26 27 1 7 58 7 1 8 46 22 1 9 36 5 1 10 38 18 1 11 37 18 1 12 65 9 1 13 17 27 2 14 23 52 1 15 23 32 1 16 54 24 1 17 25 22 1 18 25 55 1 19 25 24 1 20 67 13 1 21 7 9 ar 22 7 15 ar 23 27 29 1 24 18 5 1 25 18 2 1 26 22 45 1 27 22 4 1 28 9 16 ar 29 5 15 1 30 5 31 1 31 24 53 1 32 24 28 1 33 15 8 ar 34 69 13 1 35 13 68 1 36 13 30 1 37 32 31 2 38 32 33 1 39 31 3 1 40 28 4 1 41 16 30 1 42 16 10 ar 43 4 2 1 44 4 20 1 45 34 1 1 46 72 14 1 47 2 1 1 48 2 11 1 49 29 33 2 50 29 57 1 51 8 10 ar 52 8 59 1 53 48 11 1 54 30 14 1 55 33 6 1 56 10 66 1 57 1 3 1 58 1 19 1 59 14 71 1 60 14 70 1 61 11 49 1 62 11 47 1 63 3 35 1 64 3 21 1 65 41 20 1 66 20 19 1 67 20 42 1 68 43 21 1 69 19 40 1 70 19 39 1 71 21 6 1 72 21 44 1 73 6 50 1 74 6 12 1 75 60 12 1 76 12 61 1 77 12 62 1