@MOLECULE (1s,9r)-10-[(2s)-2-(benzyloxy)propyl]-13,13-dimethyl-10-azatricyclo[7.3.1.0~2,7~]trideca-2,4,6-triene 57 60 0 0 0 SMALL GASTEIGER @ATOM 1 O -2.7373 2.0387 0.8539 O.3 1 UNL1111111111 -0.4147 2 N 0.1247 0.5130 0.0750 N.3 1 UNL1111111111 -0.4533 3 C 1.3432 -1.5624 0.6280 C.3 1 UNL1111111111 0.0921 4 C 0.9734 -0.1268 1.1054 C.3 1 UNL1111111111 0.0503 5 C 2.1570 -1.4021 -0.6779 C.3 1 UNL1111111111 -0.1362 6 C 1.3005 -0.6901 -1.7445 C.3 1 UNL1111111111 -0.2756 7 C 2.2585 0.6658 1.4599 C.3 1 UNL1111111111 -0.3418 8 C 0.8084 0.6741 -1.2298 C.3 1 UNL1111111111 -0.1020 9 C 3.3902 -0.5738 -0.4427 C.ar 1 UNL1111111111 -0.0204 10 C 0.0688 -2.3866 0.3944 C.3 1 UNL1111111111 -0.4588 11 C 2.1783 -2.2907 1.6927 C.3 1 UNL1111111111 -0.4763 12 C 3.4127 0.4263 0.5365 C.ar 1 UNL1111111111 0.0029 13 C -0.4493 1.7982 0.5318 C.3 1 UNL1111111111 -0.1455 14 C 4.5118 -0.7807 -1.2482 C.ar 1 UNL1111111111 -0.1729 15 C 4.5561 1.2157 0.6876 C.ar 1 UNL1111111111 -0.1866 16 C -1.7915 2.0212 -0.2126 C.3 1 UNL1111111111 0.1276 17 C 5.6480 0.0077 -1.0910 C.ar 1 UNL1111111111 -0.1540 18 C 5.6682 1.0102 -0.1236 C.ar 1 UNL1111111111 -0.1479 19 C -1.8311 3.3641 -0.9397 C.3 1 UNL1111111111 -0.4956 20 C -4.0619 1.7241 0.4883 C.3 1 UNL1111111111 -0.0479 21 C -4.2443 0.2733 0.1475 C.ar 1 UNL1111111111 -0.0434 22 C -5.3833 -0.1167 -0.5598 C.ar 1 UNL1111111111 -0.1791 23 C -3.3086 -0.6808 0.5455 C.ar 1 UNL1111111111 -0.1357 24 C -5.5814 -1.4596 -0.8689 C.ar 1 UNL1111111111 -0.1468 25 C -3.5103 -2.0237 0.2342 C.ar 1 UNL1111111111 -0.1450 26 C -4.6456 -2.4143 -0.4732 C.ar 1 UNL1111111111 -0.1595 27 H 0.3425 -0.2133 2.0292 H 1 UNL1111111111 0.1391 28 H 2.4395 -2.4145 -1.0511 H 1 UNL1111111111 0.1421 29 H 0.4357 -1.3251 -2.0147 H 1 UNL1111111111 0.1534 30 H 1.8861 -0.5473 -2.6701 H 1 UNL1111111111 0.1361 31 H 2.5668 0.3984 2.4936 H 1 UNL1111111111 0.1582 32 H 2.0233 1.7486 1.4980 H 1 UNL1111111111 0.1539 33 H 0.0748 1.0985 -1.9498 H 1 UNL1111111111 0.1343 34 H 1.6617 1.3856 -1.1758 H 1 UNL1111111111 0.1222 35 H -0.4321 -2.6133 1.3409 H 1 UNL1111111111 0.1418 36 H 0.2876 -3.3318 -0.1088 H 1 UNL1111111111 0.1384 37 H -0.6539 -1.8320 -0.2237 H 1 UNL1111111111 0.1723 38 H 1.6745 -2.2900 2.6641 H 1 UNL1111111111 0.1467 39 H 3.1651 -1.8349 1.8291 H 1 UNL1111111111 0.1529 40 H 2.3490 -3.3347 1.4079 H 1 UNL1111111111 0.1479 41 H 0.2319 2.6599 0.3854 H 1 UNL1111111111 0.1249 42 H -0.6615 1.7484 1.6260 H 1 UNL1111111111 0.1606 43 H 4.4962 -1.5615 -2.0058 H 1 UNL1111111111 0.1510 44 H 4.5784 1.9956 1.4457 H 1 UNL1111111111 0.1510 45 H -2.0139 1.1759 -0.9019 H 1 UNL1111111111 0.1445 46 H 6.5170 -0.1584 -1.7232 H 1 UNL1111111111 0.1482 47 H 6.5530 1.6305 0.0003 H 1 UNL1111111111 0.1481 48 H -1.7632 4.1969 -0.2291 H 1 UNL1111111111 0.1579 49 H -2.7667 3.4898 -1.4948 H 1 UNL1111111111 0.1482 50 H -1.0071 3.4572 -1.6541 H 1 UNL1111111111 0.1508 51 H -4.3986 2.3881 -0.3288 H 1 UNL1111111111 0.1257 52 H -4.6201 1.9837 1.4143 H 1 UNL1111111111 0.1523 53 H -6.1154 0.6244 -0.8712 H 1 UNL1111111111 0.1458 54 H -2.4113 -0.3692 1.0884 H 1 UNL1111111111 0.1808 55 H -6.4677 -1.7642 -1.4199 H 1 UNL1111111111 0.1434 56 H -2.7790 -2.7680 0.5432 H 1 UNL1111111111 0.1500 57 H -4.8029 -3.4619 -0.7159 H 1 UNL1111111111 0.1436 @BOND 1 1 16 1 2 1 20 1 3 2 4 1 4 2 8 1 5 2 13 1 6 3 4 1 7 3 5 1 8 3 10 1 9 3 11 1 10 4 7 1 11 4 27 1 12 5 6 1 13 5 9 1 14 5 28 1 15 6 8 1 16 6 29 1 17 6 30 1 18 7 12 1 19 7 31 1 20 7 32 1 21 8 33 1 22 8 34 1 23 9 12 ar 24 9 14 ar 25 10 35 1 26 10 36 1 27 10 37 1 28 11 38 1 29 11 39 1 30 11 40 1 31 12 15 ar 32 13 16 1 33 13 41 1 34 13 42 1 35 14 17 ar 36 14 43 1 37 15 18 ar 38 15 44 1 39 16 19 1 40 16 45 1 41 17 18 ar 42 17 46 1 43 18 47 1 44 19 48 1 45 19 49 1 46 19 50 1 47 20 21 1 48 20 51 1 49 20 52 1 50 21 22 ar 51 21 23 ar 52 22 24 ar 53 22 53 1 54 23 25 ar 55 23 54 1 56 24 26 ar 57 24 55 1 58 25 26 ar 59 25 56 1 60 26 57 1