@MOLECULE 2-(5-oxo-l-prolyl-l-histidyl)-2-azabicyclo[2.1.1]hexane-1-carboxamide 49 52 0 0 0 SMALL GASTEIGER @ATOM 1 O -5.0050 0.8172 -1.7630 O.2 1 UNL1111111111 -0.4905 2 O -1.6926 0.5773 -1.5737 O.2 1 UNL1111111111 -0.5348 3 O 1.4001 1.0798 1.0369 O.2 1 UNL1111111111 -0.5304 4 O 4.7966 3.2625 1.4737 O.2 1 UNL1111111111 -0.4960 5 N -2.5036 -0.1156 0.3965 N.am 1 UNL1111111111 -0.5350 6 N -3.6277 2.4851 -1.0749 N.am 1 UNL1111111111 -0.6450 7 N 0.8848 0.0239 -0.8864 N.am 1 UNL1111111111 -0.5795 8 N 3.1627 2.8346 -0.0739 N.am 1 UNL1111111111 -0.5830 9 N 1.4727 -3.1210 0.9245 N.ar 1 UNL1111111111 -0.3621 10 N 2.9890 -4.0579 -0.4428 N.ar 1 UNL1111111111 -0.3684 11 C -3.8630 0.4791 0.3032 C.3 1 UNL1111111111 0.1378 12 C -3.9695 -0.4309 2.1659 C.3 1 UNL1111111111 -0.1206 13 C -4.0001 1.0913 1.7674 C.3 1 UNL1111111111 -0.2975 14 C -4.7524 -0.7183 0.8339 C.3 1 UNL1111111111 -0.2858 15 C -2.5132 -0.8090 1.7252 C.3 1 UNL1111111111 -0.0671 16 C -4.1992 1.2290 -0.9578 C.2 1 UNL1111111111 0.5733 17 C -1.5201 -0.0420 -0.5428 C.2 1 UNL1111111111 0.5500 18 C -0.1758 -0.7226 -0.2191 C.3 1 UNL1111111111 0.0175 19 C -0.2153 -2.1840 -0.7166 C.3 1 UNL1111111111 -0.2935 20 C 1.6158 0.9325 -0.1484 C.2 1 UNL1111111111 0.5323 21 C 2.7293 1.6927 -0.8835 C.3 1 UNL1111111111 0.0075 22 C 1.0310 -2.9039 -0.3852 C.ar 1 UNL1111111111 0.0065 23 C 3.9861 0.7853 -1.0195 C.3 1 UNL1111111111 -0.2756 24 C 5.0077 1.3331 -0.0112 C.3 1 UNL1111111111 -0.3553 25 C 4.3650 2.5650 0.5917 C.2 1 UNL1111111111 0.5986 26 C 1.9865 -3.4948 -1.2162 C.ar 1 UNL1111111111 -0.0844 27 C 2.6784 -3.8215 0.8405 C.ar 1 UNL1111111111 0.0768 28 H -4.3262 -0.7817 3.1204 H 1 UNL1111111111 0.1535 29 H -4.9362 1.6085 1.9659 H 1 UNL1111111111 0.1596 30 H -3.1749 1.7117 2.1113 H 1 UNL1111111111 0.1575 31 H -4.6047 -1.6866 0.3602 H 1 UNL1111111111 0.1583 32 H -5.8219 -0.5049 0.8596 H 1 UNL1111111111 0.1624 33 H -1.7362 -0.4028 2.3934 H 1 UNL1111111111 0.1479 34 H -2.3735 -1.8967 1.6100 H 1 UNL1111111111 0.1362 35 H 0.0070 -0.7016 0.8929 H 1 UNL1111111111 0.1804 36 H -2.8044 2.7032 -0.5490 H 1 UNL1111111111 0.3020 37 H -3.7186 2.9691 -1.9509 H 1 UNL1111111111 0.3098 38 H -0.3940 -2.2075 -1.8205 H 1 UNL1111111111 0.1875 39 H -1.1013 -2.7081 -0.2968 H 1 UNL1111111111 0.1691 40 H 0.9446 -0.0528 -1.8888 H 1 UNL1111111111 0.3299 41 H 2.3709 2.0524 -1.8804 H 1 UNL1111111111 0.1668 42 H 4.3823 0.8324 -2.0487 H 1 UNL1111111111 0.1574 43 H 3.7518 -0.2755 -0.8269 H 1 UNL1111111111 0.1615 44 H 5.9676 1.5992 -0.4897 H 1 UNL1111111111 0.1777 45 H 5.2557 0.6075 0.7866 H 1 UNL1111111111 0.1786 46 H 2.4654 3.4420 0.3293 H 1 UNL1111111111 0.3251 47 H 1.0386 -2.7691 1.7495 H 1 UNL1111111111 0.3144 48 H 2.0150 -3.5576 -2.2876 H 1 UNL1111111111 0.1804 49 H 3.2520 -4.1252 1.6984 H 1 UNL1111111111 0.1881 @BOND 1 1 16 2 2 2 17 2 3 3 20 2 4 4 25 2 5 5 11 1 6 5 15 1 7 5 17 am 8 6 16 am 9 6 36 1 10 6 37 1 11 7 18 1 12 7 20 am 13 7 40 1 14 8 21 1 15 8 25 am 16 8 46 1 17 9 22 ar 18 9 27 ar 19 9 47 1 20 10 26 ar 21 10 27 ar 22 11 13 1 23 11 14 1 24 11 16 1 25 12 13 1 26 12 14 1 27 12 15 1 28 12 28 1 29 13 29 1 30 13 30 1 31 14 31 1 32 14 32 1 33 15 33 1 34 15 34 1 35 17 18 1 36 18 19 1 37 18 35 1 38 19 22 1 39 19 38 1 40 19 39 1 41 20 21 1 42 21 23 1 43 21 41 1 44 22 26 ar 45 23 24 1 46 23 42 1 47 23 43 1 48 24 25 1 49 24 44 1 50 24 45 1 51 26 48 1 52 27 49 1