@MOLECULE n~2~-(phosphonoacetyl)-l-asparagine 27 26 0 0 0 SMALL GASTEIGER @ATOM 1 O 2.8843 1.3811 0.3837 O.2 0 UNK0 -0.3530 2 P 3.0551 -0.0379 0.0895 P.3 0 UNK0 0.3062 3 O 3.3010 -0.3931 -1.4498 O.3 0 UNK0 -0.3843 4 O 4.2743 -0.7497 0.8477 O.3 0 UNK0 -0.4016 5 C 1.7671 -1.2662 0.5057 C.3 0 UNK0 -0.2688 6 C 0.4161 -0.9366 -0.0990 C.2 0 UNK0 0.6329 7 O -0.0243 -1.5261 -1.0665 O.2 0 UNK0 -0.5377 8 N -0.3784 -0.0083 0.5654 N.am 1 ASN1 -0.6075 9 CA -1.5997 0.4856 -0.0777 C.3 1 ASN1 0.0392 10 C -1.5173 2.0128 -0.0813 C.2 1 ASN1 0.5934 11 O -1.2317 2.7155 0.8500 O.2 1 ASN1 -0.4891 12 OXT -1.8562 2.4997 -1.2910 O.3 1 ASN1 -0.5346 13 CB -2.8712 0.1311 0.7155 C.3 1 ASN1 -0.3972 14 CG -3.5820 -1.1124 0.2158 C.2 1 ASN1 0.5902 15 OD1 -4.7802 -1.1415 0.0273 O.2 1 ASN1 -0.5239 16 ND2 -2.8159 -2.2478 0.0482 N.am 1 ASN1 -0.6789 17 H 3.7304 0.3982 -1.9294 H 0 UNK0 0.3249 18 H 5.0963 -0.1487 0.8139 H 0 UNK0 0.3269 19 H 1.7128 -1.3714 1.6305 H 0 UNK0 0.2101 20 H 2.0984 -2.2798 0.1044 H 0 UNK0 0.2296 21 H -0.0203 0.5624 1.3290 H 1 ASN1 0.3366 22 HA -1.6694 0.0960 -1.1387 H 1 ASN1 0.2119 23 HXT -1.8628 3.4918 -1.3394 H 1 ASN1 0.3608 24 HB1 -3.6079 0.9704 0.6687 H 1 ASN1 0.1947 25 HB2 -2.6460 0.0154 1.7984 H 1 ASN1 0.1905 26 HD21 -3.2295 -3.0792 -0.3267 H 1 ASN1 0.3102 27 HD22 -1.8176 -2.1897 0.0291 H 1 ASN1 0.3184 @BOND 1 1 2 2 2 2 3 1 3 2 5 1 4 2 4 1 5 3 17 1 6 4 18 1 7 5 6 1 8 5 19 1 9 5 20 1 10 6 8 am 11 6 7 2 12 8 9 1 13 8 21 1 14 9 13 1 15 9 10 1 16 9 22 1 17 10 11 2 18 10 12 1 19 12 23 1 20 13 14 1 21 13 24 1 22 13 25 1 23 14 15 2 24 14 16 am 25 16 26 1 26 16 27 1