@MOLECULE methyl (1r,2s,3s,5s)-8-(3-fluoropropyl)-3-(4-iodophenyl)-8-azabicyclo[3.2.1]octane-2-carboxylate 46 48 0 0 0 SMALL USER_CHARGES @ATOM 1 I -5.0754 0.3264 -0.0583 I 1 UNL111111 -0.0306 2 F 7.4962 1.6473 -0.9107 F 1 UNL111111 -0.2219 3 O 0.9213 1.2576 -0.1008 O.3 1 UNL111111 -0.3792 4 O 2.1965 1.6648 1.7004 O.2 1 UNL111111 -0.5419 5 N 3.7862 -0.4584 -0.2956 N.3 1 UNL111111 -0.4585 6 C 3.3350 -0.9262 1.0414 C.3 1 UNL111111 0.0570 7 C 3.3456 -1.5701 -1.1804 C.3 1 UNL111111 0.0631 8 C 1.8046 -0.6286 1.0705 C.3 1 UNL111111 -0.2050 9 C 1.0767 -1.4419 -0.0286 C.3 1 UNL111111 -0.0965 10 C 3.6144 -2.4561 1.0867 C.3 1 UNL111111 -0.3101 11 C 1.8255 -1.3466 -1.3725 C.3 1 UNL111111 -0.2938 12 C 3.6381 -2.8839 -0.3963 C.3 1 UNL111111 -0.3144 13 C 5.2222 -0.1282 -0.3650 C.3 1 UNL111111 -0.0972 14 C -0.3723 -1.0376 -0.0973 C.ar 1 UNL111111 0.0076 15 C 1.6872 0.8732 0.9451 C.2 1 UNL111111 0.6217 16 C 5.3742 1.3423 0.0718 C.3 1 UNL111111 -0.3253 17 C -1.2018 -1.3832 0.9755 C.ar 1 UNL111111 -0.1712 18 C -0.9109 -0.3279 -1.1716 C.ar 1 UNL111111 -0.1281 19 C 6.8401 1.7141 0.2814 C.3 1 UNL111111 -0.0507 20 C -2.5409 -1.0026 0.9922 C.ar 1 UNL111111 -0.1443 21 C -2.2509 0.0572 -1.1689 C.ar 1 UNL111111 -0.1530 22 C -3.0498 -0.2787 -0.0817 C.ar 1 UNL111111 -0.0689 23 C 0.8057 2.6665 -0.2900 C.3 1 UNL111111 -0.1778 24 H 3.8443 -0.3799 1.8652 H 1 UNL111111 0.1516 25 H 3.8641 -1.5432 -2.1598 H 1 UNL111111 0.1329 26 H 1.3921 -0.9118 2.0704 H 1 UNL111111 0.1669 27 H 1.1047 -2.5228 0.2861 H 1 UNL111111 0.1532 28 H 2.8561 -2.9989 1.6667 H 1 UNL111111 0.1442 29 H 4.5790 -2.6580 1.5769 H 1 UNL111111 0.1400 30 H 1.4167 -2.0738 -2.0923 H 1 UNL111111 0.1405 31 H 1.6867 -0.3355 -1.8122 H 1 UNL111111 0.1705 32 H 4.6179 -3.2956 -0.6791 H 1 UNL111111 0.1370 33 H 2.8981 -3.6643 -0.6197 H 1 UNL111111 0.1453 34 H 5.8539 -0.7934 0.2577 H 1 UNL111111 0.1191 35 H 5.5750 -0.2441 -1.4139 H 1 UNL111111 0.1448 36 H 4.7973 1.5298 1.0018 H 1 UNL111111 0.1716 37 H 4.8962 2.0001 -0.6825 H 1 UNL111111 0.1666 38 H -0.8005 -1.9515 1.8136 H 1 UNL111111 0.1561 39 H -0.2823 -0.0453 -2.0167 H 1 UNL111111 0.1655 40 H 7.3440 1.0234 0.9961 H 1 UNL111111 0.1281 41 H 6.9370 2.7535 0.6747 H 1 UNL111111 0.1335 42 H -3.1616 -1.2765 1.8452 H 1 UNL111111 0.1631 43 H -2.6421 0.6192 -2.0170 H 1 UNL111111 0.1622 44 H 0.1315 2.7441 -1.1493 H 1 UNL111111 0.1424 45 H 1.7891 3.0954 -0.5095 H 1 UNL111111 0.1419 46 H 0.3740 3.1358 0.6004 H 1 UNL111111 0.1423 @BOND 1 25 7 1 2 30 11 1 3 43 21 1 4 39 18 1 5 31 11 1 6 35 13 1 7 11 7 1 8 11 9 1 9 7 12 1 10 7 5 1 11 18 21 ar 12 18 14 ar 13 21 22 ar 14 44 23 1 15 2 19 1 16 37 16 1 17 32 12 1 18 33 12 1 19 45 23 1 20 12 10 1 21 13 5 1 22 13 16 1 23 13 34 1 24 5 6 1 25 23 3 1 26 23 46 1 27 3 15 1 28 14 9 1 29 14 17 ar 30 22 1 1 31 22 20 ar 32 9 27 1 33 9 8 1 34 16 19 1 35 16 36 1 36 19 41 1 37 19 40 1 38 15 8 1 39 15 4 2 40 17 20 ar 41 17 38 1 42 20 42 1 43 6 8 1 44 6 10 1 45 6 24 1 46 8 26 1 47 10 29 1 48 10 28 1