@MOLECULE n-{(2r)-2-[2-(hydroxyamino)-2-oxoethyl]-4-methylpentanoyl}-3-methyl-l-valyl-n-(2-aminoethyl)-l-alaninamide 66 65 0 0 0 SMALL GASTEIGER @ATOM 1 C -4.2966 -0.3484 1.1811 C.3 1 UNL1111111111 -0.3560 2 C -5.6378 -0.4270 0.5002 C.2 1 UNL1111111111 0.5481 3 O -5.8258 -0.9499 -0.5769 O.2 1 UNL1111111111 -0.5110 4 N -6.7348 -0.0267 1.2845 N.am 1 UNL1111111111 -0.4035 5 O -7.9260 0.1649 0.5754 O.3 1 UNL1111111111 -0.2971 6 C -1.8805 -0.4695 0.6777 C.2 1 UNL1111111111 0.5726 7 O -1.6104 -0.5752 1.8577 O.2 1 UNL1111111111 -0.5476 8 C -3.2166 0.0645 0.1729 C.3 1 UNL1111111111 -0.1696 9 C -3.0647 1.5880 0.0427 C.3 1 UNL1111111111 -0.2976 10 C -4.2762 2.2681 -0.6212 C.3 1 UNL1111111111 -0.0516 11 C -4.4526 1.8053 -2.0701 C.3 1 UNL1111111111 -0.4613 12 C -4.0819 3.7898 -0.5763 C.3 1 UNL1111111111 -0.4573 13 N -0.9791 -0.8401 -0.2970 N.am 1 UNL1111111111 -0.5871 14 C 0.3622 -1.2806 0.0722 C.3 1 UNL1111111111 -0.0229 15 C 0.7024 -2.6950 -0.5061 C.3 1 UNL1111111111 0.1173 16 C -0.1742 -3.7291 0.2136 C.3 1 UNL1111111111 -0.4621 17 C 0.4465 -2.7625 -2.0144 C.3 1 UNL1111111111 -0.4722 18 C 2.1803 -2.9924 -0.2160 C.3 1 UNL1111111111 -0.4785 19 C 1.3327 -0.2261 -0.4879 C.2 1 UNL1111111111 0.5591 20 O 1.2242 0.2356 -1.6073 O.2 1 UNL1111111111 -0.5559 21 N 2.3186 0.2038 0.3694 N.am 1 UNL1111111111 -0.5896 22 C 3.3211 1.1688 -0.0785 C.3 1 UNL1111111111 0.0313 23 C 4.6983 0.5527 0.2378 C.2 1 UNL1111111111 0.5423 24 O 4.8951 -0.0772 1.2577 O.2 1 UNL1111111111 -0.5389 25 C 3.2027 2.4831 0.6988 C.3 1 UNL1111111111 -0.4641 26 N 9.2020 0.6643 0.5780 N.3 1 UNL1111111111 -0.6439 27 C 7.8639 1.2526 0.3624 C.3 1 UNL1111111111 -0.1334 28 C 7.0317 0.2194 -0.4405 C.3 1 UNL1111111111 -0.0676 29 N 5.6871 0.7401 -0.6982 N.am 1 UNL1111111111 -0.5983 30 H -4.2857 0.3278 2.0585 H 1 UNL1111111111 0.1759 31 H -4.0603 -1.3537 1.6090 H 1 UNL1111111111 0.1973 32 H -6.6883 0.7501 1.9248 H 1 UNL1111111111 0.3055 33 H -8.0470 -0.6827 0.0399 H 1 UNL1111111111 0.3140 34 H -3.4627 -0.3772 -0.8288 H 1 UNL1111111111 0.1833 35 H -2.8894 2.0313 1.0436 H 1 UNL1111111111 0.1517 36 H -2.1530 1.8222 -0.5447 H 1 UNL1111111111 0.1541 37 H -5.2000 2.0139 -0.0495 H 1 UNL1111111111 0.1227 38 H -3.5340 1.9284 -2.6522 H 1 UNL1111111111 0.1472 39 H -4.7489 0.7487 -2.1222 H 1 UNL1111111111 0.1591 40 H -5.2402 2.3757 -2.5754 H 1 UNL1111111111 0.1460 41 H -4.9459 4.3098 -1.0048 H 1 UNL1111111111 0.1451 42 H -3.9571 4.1517 0.4491 H 1 UNL1111111111 0.1404 43 H -3.1998 4.0983 -1.1483 H 1 UNL1111111111 0.1488 44 H -1.1467 -0.6967 -1.2842 H 1 UNL1111111111 0.3303 45 H 0.4360 -1.3352 1.1965 H 1 UNL1111111111 0.1875 46 H -1.2408 -3.5062 0.0907 H 1 UNL1111111111 0.1556 47 H -0.0023 -4.7361 -0.1807 H 1 UNL1111111111 0.1480 48 H 0.0293 -3.7577 1.2898 H 1 UNL1111111111 0.1503 49 H 0.9271 -1.9308 -2.5483 H 1 UNL1111111111 0.1679 50 H 0.8425 -3.6911 -2.4402 H 1 UNL1111111111 0.1489 51 H -0.6224 -2.7335 -2.2511 H 1 UNL1111111111 0.1481 52 H 2.4274 -2.8657 0.8436 H 1 UNL1111111111 0.1514 53 H 2.4321 -4.0262 -0.4811 H 1 UNL1111111111 0.1568 54 H 2.8508 -2.3461 -0.7946 H 1 UNL1111111111 0.1543 55 H 2.4613 -0.1903 1.2918 H 1 UNL1111111111 0.3348 56 H 3.1908 1.3576 -1.1804 H 1 UNL1111111111 0.1809 57 H 3.3427 2.3311 1.7782 H 1 UNL1111111111 0.1676 58 H 3.9429 3.2179 0.3663 H 1 UNL1111111111 0.1509 59 H 2.2066 2.9270 0.5616 H 1 UNL1111111111 0.1694 60 H 9.8652 1.3495 0.8990 H 1 UNL1111111111 0.2508 61 H 9.1736 -0.0950 1.2402 H 1 UNL1111111111 0.2514 62 H 7.9727 2.1912 -0.2201 H 1 UNL1111111111 0.1386 63 H 7.3352 1.5081 1.3057 H 1 UNL1111111111 0.1288 64 H 6.9628 -0.7376 0.1301 H 1 UNL1111111111 0.1664 65 H 7.5365 -0.0150 -1.4035 H 1 UNL1111111111 0.1543 66 H 5.5529 1.2931 -1.5252 H 1 UNL1111111111 0.3124 @BOND 1 1 8 1 2 1 30 1 3 1 31 1 4 2 3 2 5 2 1 1 6 4 2 am 7 4 32 1 8 5 4 1 9 5 33 1 10 6 8 1 11 6 7 2 12 8 9 1 13 8 34 1 14 9 10 1 15 9 35 1 16 9 36 1 17 10 12 1 18 10 37 1 19 11 10 1 20 11 38 1 21 11 39 1 22 11 40 1 23 12 41 1 24 12 42 1 25 12 43 1 26 13 6 am 27 13 14 1 28 13 44 1 29 14 15 1 30 14 19 1 31 14 45 1 32 15 17 1 33 15 18 1 34 15 16 1 35 16 46 1 36 16 47 1 37 16 48 1 38 17 49 1 39 17 50 1 40 17 51 1 41 18 52 1 42 18 53 1 43 18 54 1 44 19 21 am 45 20 19 2 46 21 55 1 47 22 25 1 48 22 21 1 49 22 23 1 50 22 56 1 51 23 24 2 52 25 57 1 53 25 58 1 54 25 59 1 55 26 60 1 56 26 61 1 57 27 26 1 58 27 62 1 59 27 63 1 60 28 27 1 61 28 64 1 62 28 65 1 63 29 23 am 64 29 28 1 65 29 66 1