@MOLECULE (1r,2r,3s,5s)-3-(benzoyloxy)-8-azabicyclo[3.2.1]octane-2-carboxylic acid 37 39 0 0 0 SMALL USER_CHARGES @ATOM 1 O -0.3700 0.5662 0.4704 O.3 1 UNL1111111 -0.4185 2 O 1.4280 -2.5194 -1.3896 O.3 1 UNL1111111 -0.5849 3 O 0.3025 -2.0136 0.4592 O.2 1 UNL1111111 -0.4983 4 O -0.9115 1.4539 -1.5194 O.2 1 UNL1111111 -0.5202 5 N 3.4308 -0.7192 0.6706 N.3 1 UNL1111111 -0.5496 6 C 3.0866 -0.3192 -0.7200 C.3 1 UNL1111111 0.0647 7 C 3.2036 0.5405 1.4322 C.3 1 UNL1111111 0.0608 8 C 1.5351 -0.2698 -0.7780 C.3 1 UNL1111111 -0.2537 9 C 3.6922 1.1030 -0.9059 C.3 1 UNL1111111 -0.3192 10 C 3.7859 1.6710 0.5275 C.3 1 UNL1111111 -0.3223 11 C 1.6762 0.6891 1.5917 C.3 1 UNL1111111 -0.3217 12 C 1.0151 0.7976 0.2107 C.3 1 UNL1111111 0.1594 13 C 1.0075 -1.6362 -0.4354 C.2 1 UNL1111111 0.6760 14 C -1.2526 0.8915 -0.5075 C.2 1 UNL1111111 0.6065 15 C -2.6070 0.4567 -0.1298 C.ar 1 UNL1111111 -0.1478 16 C -3.7032 1.1159 -0.6894 C.ar 1 UNL1111111 -0.0813 17 C -2.7855 -0.6098 0.7530 C.ar 1 UNL1111111 -0.0677 18 C -4.9911 0.7093 -0.3519 C.ar 1 UNL1111111 -0.1821 19 C -4.0775 -1.0125 1.0835 C.ar 1 UNL1111111 -0.1800 20 C -5.1760 -0.3528 0.5340 C.ar 1 UNL1111111 -0.1000 21 H 3.4763 -1.0522 -1.4584 H 1 UNL1111111 0.1537 22 H 3.6953 0.4972 2.4246 H 1 UNL1111111 0.1339 23 H 1.2044 -0.0054 -1.8165 H 1 UNL1111111 0.1937 24 H 3.0766 1.7323 -1.5646 H 1 UNL1111111 0.1533 25 H 4.6830 1.0444 -1.3810 H 1 UNL1111111 0.1423 26 H 4.8260 1.8960 0.8034 H 1 UNL1111111 0.1381 27 H 3.2289 2.6112 0.6397 H 1 UNL1111111 0.1486 28 H 1.2713 -0.2060 2.1186 H 1 UNL1111111 0.1909 29 H 1.4219 1.5589 2.2178 H 1 UNL1111111 0.1491 30 H 1.1278 1.8163 -0.2253 H 1 UNL1111111 0.1438 31 H 4.3856 -1.0534 0.7508 H 1 UNL1111111 0.2617 32 H 1.1425 -3.4473 -1.2189 H 1 UNL1111111 0.3540 33 H -3.5441 1.9391 -1.3888 H 1 UNL1111111 0.1668 34 H -1.9145 -1.1275 1.1740 H 1 UNL1111111 0.1905 35 H -5.8519 1.2173 -0.7811 H 1 UNL1111111 0.1546 36 H -4.2266 -1.8437 1.7701 H 1 UNL1111111 0.1572 37 H -6.1848 -0.6697 0.7954 H 1 UNL1111111 0.1477 @BOND 1 23 8 1 2 24 9 1 3 4 14 2 4 21 6 1 5 2 32 1 6 2 13 1 7 33 16 1 8 25 9 1 9 9 6 1 10 9 10 1 11 35 18 1 12 8 6 1 13 8 13 1 14 8 12 1 15 6 5 1 16 16 18 ar 17 16 15 ar 18 14 15 1 19 14 1 1 20 13 3 2 21 18 20 ar 22 30 12 1 23 15 17 ar 24 12 1 1 25 12 11 1 26 10 27 1 27 10 26 1 28 10 7 1 29 20 37 1 30 20 19 ar 31 5 31 1 32 5 7 1 33 17 19 ar 34 17 34 1 35 19 36 1 36 7 11 1 37 7 22 1 38 11 28 1 39 11 29 1