@MOLECULE (2s,3r)-2-allyl-n~1~-hydroxy-3-isobutyl-n~4~-[(2s)-1-(methylamino)-1-oxo-3-phenyl-2-propanyl]succinamide 59 59 0 0 0 SMALL GASTEIGER @ATOM 1 O -0.0849 -0.7557 1.9237 O.2 1 UNL1111111111 -0.5309 2 O 4.4311 0.9327 -0.0407 O.2 1 UNL1111111111 -0.4819 3 O 4.8392 1.5667 -2.5684 O.3 1 UNL1111111111 -0.2959 4 O -0.5232 -3.0458 -1.2413 O.2 1 UNL1111111111 -0.5497 5 N -0.5383 -0.4628 -0.2645 N.am 1 UNL1111111111 -0.5988 6 N 3.6357 0.9732 -2.1706 N.am 1 UNL1111111111 -0.4095 7 N -2.1438 -3.6665 0.2152 N.am 1 UNL1111111111 -0.5715 8 C 1.5904 0.4078 0.6091 C.3 1 UNL1111111111 -0.1839 9 C 1.3139 1.8734 0.2489 C.3 1 UNL1111111111 -0.2950 10 C 2.4020 -0.3188 -0.4864 C.3 1 UNL1111111111 -0.1919 11 C 0.4052 2.5690 1.2850 C.3 1 UNL1111111111 -0.0562 12 C 0.2788 -0.3299 0.8490 C.2 1 UNL1111111111 0.5898 13 C 2.8278 -1.7233 -0.0210 C.3 1 UNL1111111111 -0.2897 14 C 3.6245 0.5127 -0.8344 C.2 1 UNL1111111111 0.5311 15 C -0.0131 3.9461 0.7540 C.3 1 UNL1111111111 -0.4548 16 C 1.1279 2.7108 2.6301 C.3 1 UNL1111111111 -0.4552 17 C -1.7552 -1.2550 -0.1850 C.3 1 UNL1111111111 0.0265 18 C -2.7465 -0.8049 -1.2785 C.3 1 UNL1111111111 -0.3150 19 C 3.5361 -1.7021 1.2957 C.2 1 UNL1111111111 -0.1235 20 C -1.3894 -2.7317 -0.4498 C.2 1 UNL1111111111 0.5399 21 C -3.4642 0.4293 -0.8288 C.ar 1 UNL1111111111 0.0179 22 C 3.1974 -2.4816 2.3200 C.2 1 UNL1111111111 -0.3141 23 C -4.6706 0.2983 -0.1379 C.ar 1 UNL1111111111 -0.1730 24 C -2.9340 1.6971 -1.0736 C.ar 1 UNL1111111111 -0.1593 25 C -5.3495 1.4334 0.2960 C.ar 1 UNL1111111111 -0.1350 26 C -3.6163 2.8310 -0.6375 C.ar 1 UNL1111111111 -0.1371 27 C -1.8684 -5.0906 0.0217 C.3 1 UNL1111111111 -0.2303 28 C -4.8246 2.6999 0.0452 C.ar 1 UNL1111111111 -0.1576 29 H 2.1759 0.3793 1.5707 H 1 UNL1111111111 0.2015 30 H 0.8576 1.9505 -0.7548 H 1 UNL1111111111 0.1400 31 H 2.2748 2.4264 0.1867 H 1 UNL1111111111 0.1601 32 H 1.7678 -0.4443 -1.4010 H 1 UNL1111111111 0.1529 33 H -0.5178 1.9559 1.4367 H 1 UNL1111111111 0.1418 34 H 3.4781 -2.2010 -0.7837 H 1 UNL1111111111 0.1555 35 H 1.9205 -2.3709 0.0191 H 1 UNL1111111111 0.1733 36 H -0.6323 4.4768 1.4851 H 1 UNL1111111111 0.1438 37 H -0.5987 3.8596 -0.1666 H 1 UNL1111111111 0.1365 38 H 0.8566 4.5780 0.5428 H 1 UNL1111111111 0.1453 39 H 2.1097 3.1734 2.5146 H 1 UNL1111111111 0.1455 40 H 0.5495 3.3251 3.3294 H 1 UNL1111111111 0.1433 41 H 1.2707 1.7317 3.1036 H 1 UNL1111111111 0.1543 42 H -0.2052 -0.2386 -1.1901 H 1 UNL1111111111 0.3151 43 H -2.2070 -1.1278 0.8385 H 1 UNL1111111111 0.1847 44 H -3.4648 -1.6224 -1.5007 H 1 UNL1111111111 0.1644 45 H -2.2155 -0.6390 -2.2396 H 1 UNL1111111111 0.1664 46 H 4.3658 -0.9942 1.3582 H 1 UNL1111111111 0.1631 47 H 3.3859 0.3650 -2.9365 H 1 UNL1111111111 0.3027 48 H 2.3783 -3.1866 2.3035 H 1 UNL1111111111 0.1464 49 H 3.7166 -2.4703 3.2657 H 1 UNL1111111111 0.1447 50 H -2.7764 -3.4207 0.9560 H 1 UNL1111111111 0.3123 51 H -5.0832 -0.6859 0.0608 H 1 UNL1111111111 0.1483 52 H -1.9852 1.8009 -1.5946 H 1 UNL1111111111 0.1523 53 H 4.9667 2.3403 -1.9306 H 1 UNL1111111111 0.3101 54 H -6.2909 1.3312 0.8320 H 1 UNL1111111111 0.1465 55 H -3.2055 3.8210 -0.8264 H 1 UNL1111111111 0.1481 56 H -2.8093 -5.6397 -0.1482 H 1 UNL1111111111 0.1390 57 H -1.3487 -5.5222 0.8951 H 1 UNL1111111111 0.1419 58 H -1.2191 -5.2447 -0.8645 H 1 UNL1111111111 0.1759 59 H -5.3600 3.5849 0.3803 H 1 UNL1111111111 0.1493 @BOND 1 1 12 2 2 2 14 2 3 3 6 1 4 3 53 1 5 4 20 2 6 5 12 am 7 5 17 1 8 5 42 1 9 6 14 am 10 6 47 1 11 7 20 am 12 7 27 1 13 7 50 1 14 8 9 1 15 8 10 1 16 8 12 1 17 8 29 1 18 9 11 1 19 9 30 1 20 9 31 1 21 10 13 1 22 10 14 1 23 10 32 1 24 11 15 1 25 11 16 1 26 11 33 1 27 13 19 1 28 13 34 1 29 13 35 1 30 15 36 1 31 15 37 1 32 15 38 1 33 16 39 1 34 16 40 1 35 16 41 1 36 17 18 1 37 17 20 1 38 17 43 1 39 18 21 1 40 18 44 1 41 18 45 1 42 19 22 2 43 19 46 1 44 21 23 ar 45 21 24 ar 46 22 48 1 47 22 49 1 48 23 25 ar 49 23 51 1 50 24 26 ar 51 24 52 1 52 25 28 ar 53 25 54 1 54 26 28 ar 55 26 55 1 56 27 56 1 57 27 57 1 58 27 58 1 59 28 59 1