@MOLECULE 4-hydroxy-3,5,14-trimethoxy-18-methyl-18-azatetracyclo[8.5.3.0~1,11~.0~2,7~]octadeca-2,4,6,11,14-pentaen-13-one 52 55 0 0 0 SMALL GASTEIGER @ATOM 1 O -0.9372 1.2857 -1.9608 O.3 1 UNL111111111111111 -0.3063 2 O 2.8855 2.9314 -0.1423 O.2 1 UNL111111111111111 -0.3045 3 O 3.9023 1.1729 1.9459 O.2 1 UNL111111111111111 -0.4600 4 O -4.4965 0.6681 1.1209 O.3 1 UNL111111111111111 -0.3410 5 O -3.5986 1.7445 -1.1547 O.3 1 UNL111111111111111 -0.4578 6 N 1.3223 -3.0269 -1.1792 N.3 1 UNL111111111111111 -0.4164 7 C 0.8748 -0.1550 -0.5840 C.3 1 UNL111111111111111 0.0721 8 C 1.4263 -2.5587 0.2199 C.3 1 UNL111111111111111 0.0270 9 C 1.7469 -1.0763 0.2416 C.2 1 UNL111111111111111 0.1208 10 C 0.9114 -0.7712 -2.0118 C.3 1 UNL111111111111111 -0.2765 11 C 0.3851 -2.2126 -1.9845 C.3 1 UNL111111111111111 -0.1119 12 C -0.5515 -0.0306 -0.0733 C.ar 1 UNL111111111111111 -0.1355 13 C 0.1871 -2.8152 1.1168 C.3 1 UNL111111111111111 -0.3090 14 C -0.2163 -1.5809 1.9302 C.3 1 UNL111111111111111 -0.2808 15 C -1.0306 -0.6442 1.0852 C.ar 1 UNL111111111111111 0.0705 16 C 1.4527 1.2324 -0.6530 C.2 1 UNL111111111111111 -0.2374 17 C 2.7855 -0.6457 0.9754 C.2 1 UNL111111111111111 -0.3772 18 C -1.4527 0.7788 -0.8146 C.ar 1 UNL111111111111111 0.2152 19 C 0.9917 -4.4630 -1.2583 C.3 1 UNL111111111111111 -0.2776 20 C 2.4736 1.6587 0.1101 C.2 1 UNL111111111111111 0.0752 21 C 3.1345 0.7727 1.1001 C.2 1 UNL111111111111111 0.4600 22 C -2.3463 -0.4376 1.5272 C.ar 1 UNL111111111111111 -0.3271 23 C -2.7697 0.9721 -0.3901 C.ar 1 UNL111111111111111 0.0373 24 C -3.2057 0.3687 0.8011 C.ar 1 UNL111111111111111 0.1832 25 C -1.6338 2.3437 -2.6103 C.3 1 UNL111111111111111 -0.1853 26 C 3.7688 3.5347 0.7955 C.3 1 UNL111111111111111 -0.1935 27 C -5.0554 -0.0150 2.2344 C.3 1 UNL111111111111111 -0.1829 28 H 2.2977 -3.1288 0.6530 H 1 UNL111111111111111 0.1489 29 H 1.9564 -0.7583 -2.3844 H 1 UNL111111111111111 0.1637 30 H 0.3279 -0.1691 -2.7300 H 1 UNL111111111111111 0.1658 31 H -0.6584 -2.2365 -1.6031 H 1 UNL111111111111111 0.1252 32 H 0.3651 -2.6251 -3.0164 H 1 UNL111111111111111 0.1377 33 H 0.3962 -3.6606 1.7958 H 1 UNL111111111111111 0.1381 34 H -0.6718 -3.1387 0.4969 H 1 UNL111111111111111 0.1529 35 H 0.6643 -1.0603 2.3627 H 1 UNL111111111111111 0.1721 36 H -0.7893 -1.9082 2.8237 H 1 UNL111111111111111 0.1479 37 H 0.9949 1.9079 -1.3778 H 1 UNL111111111111111 0.1911 38 H 3.4305 -1.3228 1.5346 H 1 UNL111111111111111 0.1819 39 H 1.7084 -5.0398 -0.6511 H 1 UNL111111111111111 0.1445 40 H 1.1175 -4.7925 -2.3045 H 1 UNL111111111111111 0.1489 41 H -0.0273 -4.7212 -0.9344 H 1 UNL111111111111111 0.1187 42 H -2.6822 -0.9149 2.4426 H 1 UNL111111111111111 0.1690 43 H -4.4996 1.7880 -0.7437 H 1 UNL111111111111111 0.3333 44 H -2.5312 1.9560 -3.1048 H 1 UNL111111111111111 0.1453 45 H -0.8937 2.6813 -3.3471 H 1 UNL111111111111111 0.1414 46 H -1.8843 3.1491 -1.9129 H 1 UNL111111111111111 0.1452 47 H 3.8384 4.5602 0.4129 H 1 UNL111111111111111 0.1382 48 H 4.7472 3.0431 0.7789 H 1 UNL111111111111111 0.1435 49 H 3.3489 3.5211 1.8061 H 1 UNL111111111111111 0.1439 50 H -4.5390 0.2669 3.1581 H 1 UNL111111111111111 0.1372 51 H -5.0387 -1.0982 2.0784 H 1 UNL111111111111111 0.1353 52 H -6.0879 0.3597 2.2401 H 1 UNL111111111111111 0.1494 @BOND 1 1 18 1 2 1 25 1 3 2 20 1 4 2 26 1 5 3 21 2 6 4 24 1 7 4 27 1 8 5 23 1 9 5 43 1 10 6 8 1 11 6 11 1 12 6 19 1 13 7 9 1 14 7 10 1 15 7 12 1 16 7 16 1 17 8 9 1 18 8 13 1 19 8 28 1 20 9 17 2 21 10 11 1 22 10 29 1 23 10 30 1 24 11 31 1 25 11 32 1 26 12 15 ar 27 12 18 ar 28 13 14 1 29 13 33 1 30 13 34 1 31 14 15 1 32 14 35 1 33 14 36 1 34 15 22 ar 35 16 20 2 36 16 37 1 37 17 21 1 38 17 38 1 39 18 23 ar 40 19 39 1 41 19 40 1 42 19 41 1 43 20 21 1 44 22 24 ar 45 22 42 1 46 23 24 ar 47 25 44 1 48 25 45 1 49 25 46 1 50 26 47 1 51 26 48 1 52 26 49 1 53 27 50 1 54 27 51 1 55 27 52 1