@MOLECULE n-(3-carboxypropanoyl)-l-valyl-n-[(1r)-2-phenyl-1-phosphonoethyl]-l-prolinamide 66 67 0 0 0 SMALL GASTEIGER @ATOM 1 C 8.4918 -1.8062 0.1231 C.2 1 UNL111111111 0.6449 2 O 8.1754 -2.9318 0.4068 O.2 1 UNL111111111 -0.5136 3 O 9.8029 -1.4689 -0.0010 O.3 1 UNL111111111 -0.5661 4 C 7.6223 -0.6229 -0.1428 C.3 1 UNL111111111 -0.3276 5 C 6.1598 -0.9890 0.0897 C.3 1 UNL111111111 -0.3450 6 C 5.2684 0.1606 -0.3289 C.2 1 UNL111111111 0.5943 7 O 5.6861 1.2255 -0.7379 O.2 1 UNL111111111 -0.5521 8 N 3.9197 -0.0825 -0.2090 N.am 1 UNL111111111 -0.6015 9 C 2.9343 0.9189 -0.6279 C.3 1 UNL111111111 -0.0040 10 C 1.7505 0.7558 0.3327 C.2 1 UNL111111111 0.5601 11 O 1.4107 -0.3451 0.7283 O.2 1 UNL111111111 -0.5354 12 C 2.4876 0.6604 -2.0979 C.3 1 UNL111111111 -0.0778 13 C 1.7473 -0.6677 -2.2517 C.3 1 UNL111111111 -0.4563 14 C 1.6109 1.8070 -2.6013 C.3 1 UNL111111111 -0.4761 15 N 1.1146 1.8652 0.8445 N.am 1 UNL111111111 -0.4959 16 C -0.1557 1.6884 1.5540 C.3 1 UNL111111111 0.0192 17 C -1.2343 1.1458 0.5945 C.2 1 UNL111111111 0.5548 18 O -1.1596 1.2159 -0.6127 O.2 1 UNL111111111 -0.5282 19 C -0.5418 3.0950 2.0533 C.3 1 UNL111111111 -0.2858 20 C 0.2044 4.0770 1.1314 C.3 1 UNL111111111 -0.2771 21 C 1.3525 3.2706 0.4834 C.3 1 UNL111111111 -0.0595 22 O -4.6161 -2.3481 -0.0921 O.3 1 UNL111111111 -0.3815 23 P -3.4600 -1.8592 0.9016 P.3 1 UNL111111111 0.2485 24 O -2.2812 -2.7198 0.9526 O.2 1 UNL111111111 -0.3153 25 C -3.3859 -0.0418 0.4074 C.3 1 UNL111111111 0.1953 26 C -4.7145 0.7687 0.5506 C.3 1 UNL111111111 -0.2823 27 C -5.7975 0.2169 -0.3277 C.ar 1 UNL111111111 0.0274 28 C -5.6905 0.3273 -1.7166 C.ar 1 UNL111111111 -0.1682 29 C -6.7008 -0.1693 -2.5364 C.ar 1 UNL111111111 -0.1392 30 C -7.8213 -0.7794 -1.9746 C.ar 1 UNL111111111 -0.1638 31 C -7.9239 -0.9002 -0.5901 C.ar 1 UNL111111111 -0.1455 32 C -6.9156 -0.4034 0.2339 C.ar 1 UNL111111111 -0.1437 33 N -2.3497 0.6150 1.2184 N.am 1 UNL111111111 -0.5769 34 O -4.1907 -1.6690 2.3212 O.3 1 UNL111111111 -0.4358 35 H 10.4221 -2.2235 0.1531 H 1 UNL111111111 0.3557 36 H 7.9244 0.2445 0.4891 H 1 UNL111111111 0.1964 37 H 7.7804 -0.2484 -1.1829 H 1 UNL111111111 0.2011 38 H 5.8975 -1.9121 -0.4741 H 1 UNL111111111 0.1842 39 H 5.9867 -1.2448 1.1575 H 1 UNL111111111 0.1808 40 H 3.5366 -0.9671 0.1089 H 1 UNL111111111 0.3386 41 H 3.3956 1.9404 -0.5591 H 1 UNL111111111 0.1751 42 H 3.4262 0.6276 -2.7107 H 1 UNL111111111 0.1511 43 H 0.7972 -0.6748 -1.6929 H 1 UNL111111111 0.1762 44 H 1.5025 -0.8638 -3.3009 H 1 UNL111111111 0.1457 45 H 2.3364 -1.5131 -1.8826 H 1 UNL111111111 0.1472 46 H 0.6473 1.8413 -2.0671 H 1 UNL111111111 0.1752 47 H 2.1056 2.7772 -2.5044 H 1 UNL111111111 0.1377 48 H 1.3656 1.6735 -3.6621 H 1 UNL111111111 0.1551 49 H 0.0002 0.9581 2.3930 H 1 UNL111111111 0.1773 50 H -1.6307 3.2630 2.0314 H 1 UNL111111111 0.1518 51 H -0.2248 3.2296 3.1028 H 1 UNL111111111 0.1512 52 H -0.4734 4.4744 0.3552 H 1 UNL111111111 0.1493 53 H 0.5866 4.9457 1.6893 H 1 UNL111111111 0.1460 54 H 2.3450 3.5793 0.8795 H 1 UNL111111111 0.1437 55 H 1.3639 3.4148 -0.6177 H 1 UNL111111111 0.1456 56 H -4.5815 -3.3614 -0.1951 H 1 UNL111111111 0.3198 57 H -3.0736 -0.0267 -0.7007 H 1 UNL111111111 0.2094 58 H -5.0468 0.8292 1.6086 H 1 UNL111111111 0.1620 59 H -4.4926 1.8210 0.2617 H 1 UNL111111111 0.1564 60 H -4.8149 0.7975 -2.1601 H 1 UNL111111111 0.1532 61 H -6.6138 -0.0832 -3.6171 H 1 UNL111111111 0.1442 62 H -8.6098 -1.1650 -2.6149 H 1 UNL111111111 0.1431 63 H -8.7906 -1.3878 -0.1501 H 1 UNL111111111 0.1425 64 H -6.9955 -0.5128 1.3140 H 1 UNL111111111 0.1534 65 H -2.3906 0.5254 2.2258 H 1 UNL111111111 0.3194 66 H -4.1946 -2.5303 2.8515 H 1 UNL111111111 0.3212 @BOND 1 1 2 2 2 1 3 1 3 1 4 1 4 3 35 1 5 4 5 1 6 4 36 1 7 4 37 1 8 5 6 1 9 5 38 1 10 5 39 1 11 6 7 2 12 6 8 am 13 8 9 1 14 8 40 1 15 9 10 1 16 9 12 1 17 9 41 1 18 10 11 2 19 10 15 am 20 12 13 1 21 12 14 1 22 12 42 1 23 13 43 1 24 13 44 1 25 13 45 1 26 14 46 1 27 14 47 1 28 14 48 1 29 15 16 1 30 15 21 1 31 16 17 1 32 16 19 1 33 16 49 1 34 17 18 2 35 17 33 am 36 19 20 1 37 19 50 1 38 19 51 1 39 20 21 1 40 20 52 1 41 20 53 1 42 21 54 1 43 21 55 1 44 22 56 1 45 23 22 1 46 23 34 1 47 24 23 2 48 25 57 1 49 25 26 1 50 25 23 1 51 26 27 1 52 26 58 1 53 26 59 1 54 27 32 ar 55 27 28 ar 56 28 29 ar 57 28 60 1 58 29 30 ar 59 29 61 1 60 30 62 1 61 31 30 ar 62 31 63 1 63 32 31 ar 64 32 64 1 65 33 25 1 66 33 65 1 67 34 66 1