@MOLECULE methyl n-acetyl-d-phenylalaninate 31 31 0 0 0 SMALL GASTEIGER @ATOM 1 O -0.0587 2.6595 0.3845 O.3 1 UNL1111111111 -0.4059 2 O 0.1033 1.5101 -1.5459 O.2 1 UNL1111111111 -0.4912 3 O 3.5187 -0.5038 0.8929 O.2 1 UNL1111111111 -0.5370 4 N 1.6367 -0.4194 -0.3497 N.am 1 UNL1111111111 -0.6166 5 C 1.0299 0.5799 0.5210 C.3 1 UNL1111111111 0.0338 6 C 0.0124 -0.0436 1.5043 C.3 1 UNL1111111111 -0.3138 7 C -1.1555 -0.6537 0.7941 C.ar 1 UNL1111111111 0.0049 8 C 0.3185 1.5976 -0.3671 C.2 1 UNL1111111111 0.5627 9 C -2.3066 0.1031 0.5612 C.ar 1 UNL1111111111 -0.1731 10 C -1.0955 -1.9764 0.3506 C.ar 1 UNL1111111111 -0.1726 11 C 2.9080 -0.8978 -0.0789 C.2 1 UNL1111111111 0.6211 12 C -3.3832 -0.4556 -0.1221 C.ar 1 UNL1111111111 -0.1343 13 C -2.1742 -2.5326 -0.3335 C.ar 1 UNL1111111111 -0.1387 14 C -3.3178 -1.7731 -0.5729 C.ar 1 UNL1111111111 -0.1544 15 C 3.4343 -1.9110 -1.0538 C.3 1 UNL1111111111 -0.5256 16 C -0.7589 3.6921 -0.3045 C.3 1 UNL1111111111 -0.1673 17 H 1.8395 1.1009 1.1182 H 1 UNL1111111111 0.2040 18 H 0.5381 -0.8020 2.1260 H 1 UNL1111111111 0.1762 19 H -0.3208 0.7376 2.2213 H 1 UNL1111111111 0.1702 20 H 1.0927 -0.7205 -1.1463 H 1 UNL1111111111 0.3310 21 H -2.3585 1.1331 0.9086 H 1 UNL1111111111 0.1557 22 H -0.2058 -2.5730 0.5398 H 1 UNL1111111111 0.1538 23 H -4.2756 0.1393 -0.3070 H 1 UNL1111111111 0.1494 24 H -2.1237 -3.5628 -0.6802 H 1 UNL1111111111 0.1482 25 H -4.1582 -2.2070 -1.1101 H 1 UNL1111111111 0.1507 26 H 4.4816 -2.1578 -0.8134 H 1 UNL1111111111 0.1863 27 H 2.8625 -2.8479 -1.0149 H 1 UNL1111111111 0.1749 28 H 3.4157 -1.5422 -2.0884 H 1 UNL1111111111 0.1773 29 H -0.1232 4.1208 -1.0866 H 1 UNL1111111111 0.1426 30 H -0.9640 4.4202 0.4888 H 1 UNL1111111111 0.1475 31 H -1.6837 3.2980 -0.7391 H 1 UNL1111111111 0.1401 @BOND 1 1 8 1 2 1 16 1 3 2 8 2 4 3 11 2 5 4 5 1 6 4 11 am 7 4 20 1 8 5 6 1 9 5 8 1 10 5 17 1 11 6 7 1 12 6 18 1 13 6 19 1 14 7 9 ar 15 7 10 ar 16 9 12 ar 17 9 21 1 18 10 13 ar 19 10 22 1 20 11 15 1 21 12 14 ar 22 12 23 1 23 13 14 ar 24 13 24 1 25 14 25 1 26 15 26 1 27 15 27 1 28 15 28 1 29 16 29 1 30 16 30 1 31 16 31 1