@MOLECULE (5s,12s)-15-methyl-5,6,12,13-tetrahydrocycloocta[1,2-f:5,6-f']bis[1,3]benzodioxol-5,12-imine 41 46 0 0 0 SMALL GASTEIGER @ATOM 1 O -4.5097 1.4017 1.1106 O.3 1 UNL1111111111 -0.3383 2 O 4.6367 1.0436 -1.2361 O.3 1 UNL1111111111 -0.3427 3 O -4.2630 1.8895 -1.1848 O.3 1 UNL1111111111 -0.3368 4 O 4.3957 1.8895 0.9533 O.3 1 UNL1111111111 -0.3425 5 N 0.0345 -2.6535 0.2485 N.3 1 UNL1111111111 -0.4093 6 C -0.6555 -1.7191 1.1625 C.3 1 UNL1111111111 0.0584 7 C 0.6583 -1.8917 -0.8544 C.3 1 UNL1111111111 0.0628 8 C 0.4394 -0.9205 1.9156 C.3 1 UNL1111111111 -0.2792 9 C -0.3787 -1.1198 -1.7160 C.3 1 UNL1111111111 -0.3240 10 C -1.5956 -0.7586 0.4648 C.ar 1 UNL1111111111 -0.0807 11 C 1.6471 -0.8948 -0.2903 C.ar 1 UNL1111111111 -0.0411 12 C 1.5121 -0.4074 1.0079 C.ar 1 UNL1111111111 0.0316 13 C -1.4459 -0.4714 -0.8902 C.ar 1 UNL1111111111 0.0205 14 C -0.8681 -3.7138 -0.2447 C.3 1 UNL1111111111 -0.2754 15 C -2.6134 -0.1665 1.2420 C.ar 1 UNL1111111111 -0.2022 16 C 2.6874 -0.4639 -1.1413 C.ar 1 UNL1111111111 -0.2066 17 C 2.4041 0.5570 1.5277 C.ar 1 UNL1111111111 -0.2196 18 C -2.3128 0.4295 -1.5497 C.ar 1 UNL1111111111 -0.2223 19 C -3.4478 0.7039 0.5905 C.ar 1 UNL1111111111 0.1198 20 C 3.5495 0.4675 -0.6229 C.ar 1 UNL1111111111 0.1204 21 C -3.2993 0.9968 -0.7859 C.ar 1 UNL1111111111 0.1365 22 C 3.4068 0.9732 0.6903 C.ar 1 UNL1111111111 0.1349 23 C -5.0395 2.1647 0.0033 C.3 1 UNL1111111111 0.1576 24 C 5.1862 1.9510 -0.2550 C.3 1 UNL1111111111 0.1585 25 H -1.2299 -2.3307 1.9083 H 1 UNL1111111111 0.1443 26 H 1.2031 -2.6310 -1.4997 H 1 UNL1111111111 0.1467 27 H 0.9075 -1.5899 2.6721 H 1 UNL1111111111 0.1653 28 H -0.0336 -0.0905 2.4780 H 1 UNL1111111111 0.1581 29 H -0.8461 -1.8154 -2.4428 H 1 UNL1111111111 0.1552 30 H 0.1489 -0.3572 -2.3272 H 1 UNL1111111111 0.1685 31 H -0.3161 -4.3706 -0.9359 H 1 UNL1111111111 0.1434 32 H -1.7715 -3.3446 -0.7545 H 1 UNL1111111111 0.1308 33 H -1.1813 -4.3339 0.6122 H 1 UNL1111111111 0.1460 34 H -2.7248 -0.3909 2.2976 H 1 UNL1111111111 0.1747 35 H 2.7971 -0.8530 -2.1476 H 1 UNL1111111111 0.1732 36 H 2.2954 0.9428 2.5357 H 1 UNL1111111111 0.1769 37 H -2.1955 0.6578 -2.6039 H 1 UNL1111111111 0.1785 38 H -4.9195 3.2304 0.2422 H 1 UNL1111111111 0.1409 39 H -6.0662 1.8203 -0.1810 H 1 UNL1111111111 0.1393 40 H 5.1041 2.9699 -0.6572 H 1 UNL1111111111 0.1394 41 H 6.1998 1.6058 -0.0097 H 1 UNL1111111111 0.1385 @BOND 1 1 19 1 2 1 23 1 3 2 20 1 4 2 24 1 5 3 21 1 6 3 23 1 7 4 22 1 8 4 24 1 9 5 6 1 10 5 7 1 11 5 14 1 12 6 8 1 13 6 10 1 14 6 25 1 15 7 9 1 16 7 11 1 17 7 26 1 18 8 12 1 19 8 27 1 20 8 28 1 21 9 13 1 22 9 29 1 23 9 30 1 24 10 13 ar 25 10 15 ar 26 11 12 ar 27 11 16 ar 28 12 17 ar 29 13 18 ar 30 14 31 1 31 14 32 1 32 14 33 1 33 15 19 ar 34 15 34 1 35 16 20 ar 36 16 35 1 37 17 22 ar 38 17 36 1 39 18 21 ar 40 18 37 1 41 19 21 ar 42 20 22 ar 43 23 38 1 44 23 39 1 45 24 40 1 46 24 41 1