@MOLECULE methyl n-(2,6-dimethylphenyl)-n-(methoxyacetyl)-l-alaninate 41 41 0 0 0 SMALL GASTEIGER @ATOM 1 O -3.7757 -0.2740 -0.6062 O.3 1 UNL11111111 -0.4107 2 O 2.0021 2.2108 0.0450 O.3 1 UNL11111111 -0.3572 3 O -1.3017 2.3224 -0.1917 O.2 1 UNL11111111 -0.5311 4 O -2.5547 -0.3692 1.2785 O.2 1 UNL11111111 -0.5036 5 N -0.2675 0.3383 -0.2814 N.am 1 UNL11111111 -0.4929 6 C -1.4568 -0.2278 -0.9335 C.3 1 UNL11111111 0.0607 7 C 0.8906 -0.4787 -0.1053 C.ar 1 UNL11111111 0.0913 8 C 1.0758 -1.2042 1.0831 C.ar 1 UNL11111111 0.0401 9 C 1.8440 -0.5374 -1.1414 C.ar 1 UNL11111111 0.0598 10 C -1.2476 -1.6448 -1.4620 C.3 1 UNL11111111 -0.4692 11 C -0.3084 1.6752 0.0764 C.2 1 UNL11111111 0.5680 12 C -2.6061 -0.2850 0.0822 C.2 1 UNL11111111 0.5817 13 C 2.2173 -2.0002 1.2174 C.ar 1 UNL11111111 -0.2157 14 C 2.9706 -1.3454 -0.9801 C.ar 1 UNL11111111 -0.2197 15 C 0.0886 -1.1600 2.1932 C.3 1 UNL11111111 -0.4567 16 C 1.6856 0.2693 -2.3827 C.3 1 UNL11111111 -0.4539 17 C 3.1531 -2.0740 0.1918 C.ar 1 UNL11111111 -0.1191 18 C 0.8485 2.2818 0.8601 C.3 1 UNL11111111 -0.1248 19 C -4.9625 -0.2795 0.1805 C.3 1 UNL11111111 -0.1674 20 C 3.1696 1.8275 0.7507 C.3 1 UNL11111111 -0.2068 21 H -1.7614 0.4682 -1.7730 H 1 UNL11111111 0.1887 22 H -0.9632 -2.3458 -0.6644 H 1 UNL11111111 0.1676 23 H -2.1665 -2.0261 -1.9297 H 1 UNL11111111 0.1702 24 H -0.4520 -1.6837 -2.2182 H 1 UNL11111111 0.1692 25 H 2.3692 -2.5709 2.1311 H 1 UNL11111111 0.1583 26 H 3.7115 -1.4040 -1.7738 H 1 UNL11111111 0.1569 27 H -0.7396 -1.8684 2.0136 H 1 UNL11111111 0.1793 28 H 0.5266 -1.4102 3.1669 H 1 UNL11111111 0.1539 29 H -0.4023 -0.1780 2.2945 H 1 UNL11111111 0.1803 30 H 1.8249 1.3441 -2.1576 H 1 UNL11111111 0.1859 31 H 2.4111 0.0056 -3.1614 H 1 UNL11111111 0.1516 32 H 0.6819 0.1742 -2.8211 H 1 UNL11111111 0.1644 33 H 4.0342 -2.7040 0.3053 H 1 UNL11111111 0.1495 34 H 0.6521 3.3627 1.0280 H 1 UNL11111111 0.1673 35 H 0.9625 1.7740 1.8339 H 1 UNL11111111 0.1501 36 H -5.7576 -0.2504 -0.5729 H 1 UNL11111111 0.1453 37 H -4.9896 0.6084 0.8227 H 1 UNL11111111 0.1445 38 H -5.0121 -1.1907 0.7847 H 1 UNL11111111 0.1362 39 H 3.3962 2.5379 1.5504 H 1 UNL11111111 0.1251 40 H 3.9440 1.8666 -0.0265 H 1 UNL11111111 0.1482 41 H 3.0793 0.8063 1.1377 H 1 UNL11111111 0.1346 @BOND 1 1 12 1 2 1 19 1 3 2 18 1 4 2 20 1 5 3 11 2 6 4 12 2 7 5 6 1 8 5 7 1 9 5 11 am 10 6 10 1 11 6 12 1 12 6 21 1 13 7 8 ar 14 7 9 ar 15 8 13 ar 16 8 15 1 17 9 14 ar 18 9 16 1 19 10 22 1 20 10 23 1 21 10 24 1 22 11 18 1 23 13 17 ar 24 13 25 1 25 14 17 ar 26 14 26 1 27 15 27 1 28 15 28 1 29 15 29 1 30 16 30 1 31 16 31 1 32 16 32 1 33 17 33 1 34 18 34 1 35 18 35 1 36 19 36 1 37 19 37 1 38 19 38 1 39 20 39 1 40 20 40 1 41 20 41 1