@MOLECULE 3-[(3s,5s)-7-oxo-4-oxa-1-azabicyclo[3.2.0]hept-3-yl]-l-alanine 26 27 0 0 0 SMALL GASTEIGER @ATOM 1 O 0.6946 0.8053 0.5684 O.3 1 UNL1111111111 -0.4437 2 O 4.2561 -1.1028 -0.0453 O.2 1 UNL1111111111 -0.4049 3 O -3.4449 1.5012 -0.2801 O.3 1 UNL1111111111 -0.5507 4 OXT -4.4523 -0.4846 -0.1260 O.2 1 UNL1111111111 -0.5104 5 N 2.5010 0.3165 -0.8622 N.am 1 UNL1111111111 -0.5234 6 N -2.1304 -1.6878 0.9241 N.3 1 UNL1111111111 -0.6276 7 C 1.9623 1.2642 0.1889 C.3 1 UNL1111111111 0.2736 8 C 0.3354 -0.3787 -0.1637 C.3 1 UNL1111111111 0.1076 9 C 1.3940 -0.5394 -1.2938 C.3 1 UNL1111111111 -0.1470 10 C 3.1096 0.8134 1.1529 C.3 1 UNL1111111111 -0.4506 11 C 3.4860 -0.2092 0.0746 C.2 1 UNL1111111111 0.5743 12 C -1.0789 -0.1439 -0.6850 C.3 1 UNL1111111111 -0.3134 13 CA -2.0858 -0.2934 0.4716 C.3 1 UNL1111111111 0.0007 14 C -3.4562 0.1777 -0.0034 C.2 1 UNL1111111111 0.5748 15 H 1.8817 2.3193 -0.0950 H 1 UNL1111111111 0.1584 16 H 0.3781 -1.2097 0.5762 H 1 UNL1111111111 0.1632 17 H 1.7127 -1.5901 -1.4345 H 1 UNL1111111111 0.1633 18 H 1.0226 -0.1721 -2.2741 H 1 UNL1111111111 0.1642 19 H 2.7703 0.3722 2.0960 H 1 UNL1111111111 0.1915 20 H 3.8678 1.5663 1.3774 H 1 UNL1111111111 0.1820 21 H -1.3103 -0.8525 -1.5027 H 1 UNL1111111111 0.1586 22 H -1.1555 0.8787 -1.1165 H 1 UNL1111111111 0.1803 23 HA -1.7541 0.3576 1.3324 H 1 UNL1111111111 0.1923 24 H1 -2.4908 -2.3127 0.2166 H 1 UNL1111111111 0.2649 25 H2 -2.6748 -1.8022 1.7651 H 1 UNL1111111111 0.2645 26 H -4.3185 1.8558 -0.5841 H 1 UNL1111111111 0.3576 @BOND 1 1 7 1 2 1 8 1 3 2 11 2 4 3 14 1 5 3 26 1 6 4 14 2 7 5 7 1 8 5 9 1 9 5 11 am 10 6 13 1 11 6 24 1 12 6 25 1 13 7 10 1 14 7 15 1 15 8 9 1 16 8 12 1 17 8 16 1 18 9 17 1 19 9 18 1 20 10 11 1 21 10 19 1 22 10 20 1 23 12 13 1 24 12 21 1 25 12 22 1 26 13 14 1 27 13 23 1