@MOLECULE (2r)-2-amino-n-[(2s)-1-amino-3-(1-naphthyl)-1-oxo-2-propanyl]-n-(3-carbamimidamidopropyl)-3-(4-chlorophenyl)propanamide 66 68 0 0 0 SMALL GASTEIGER @ATOM 1 CL 6.7646 0.7350 1.0095 Cl 1 UNL1111111111 -0.1073 2 O 0.6559 -2.5454 0.1207 O.2 1 UNL1111111111 -0.5763 3 O 1.2360 -0.2964 2.2743 O.2 1 UNL1111111111 -0.5256 4 N -0.3843 -0.5629 0.0484 N.am 1 UNL1111111111 -0.4837 5 N 0.1680 -1.7177 -2.9094 N.3 1 UNL1111111111 -0.6272 6 N 0.0552 -1.7544 3.4952 N.am 1 UNL1111111111 -0.6819 7 N -0.7582 3.6631 -0.2468 N.pl3 1 UNL1111111111 -0.5774 8 N -2.3226 5.3664 0.0335 N.pl3 1 UNL1111111111 -0.6255 9 N -0.2983 5.9187 -1.0608 N.pl3 1 UNL1111111111 -0.6777 10 C -0.9432 -0.8103 1.3822 C.3 1 UNL1111111111 0.0324 11 C -1.8871 -2.0355 1.3584 C.3 1 UNL1111111111 -0.3214 12 C -0.4835 0.8149 -0.4480 C.3 1 UNL1111111111 -0.0604 13 C 0.4926 -1.4916 -0.4713 C.2 1 UNL1111111111 0.5322 14 C 1.1009 -1.2608 -1.8648 C.3 1 UNL1111111111 -0.0018 15 C -2.9038 -1.8850 0.2671 C.ar 1 UNL1111111111 0.0269 16 C 0.6064 1.7132 0.1588 C.3 1 UNL1111111111 -0.2914 17 C 0.2231 -0.9524 2.3832 C.2 1 UNL1111111111 0.5699 18 C 2.4175 -2.0552 -1.9761 C.3 1 UNL1111111111 -0.2933 19 C -4.0290 -1.0230 0.4278 C.ar 1 UNL1111111111 -0.0250 20 C 0.5638 3.1095 -0.4892 C.3 1 UNL1111111111 -0.0719 21 C -2.7271 -2.5758 -0.9093 C.ar 1 UNL1111111111 -0.1826 22 C -4.9271 -0.8700 -0.6529 C.ar 1 UNL1111111111 0.0032 23 C 3.5075 -1.3534 -1.2277 C.ar 1 UNL1111111111 -0.0079 24 C -4.2893 -0.3170 1.6362 C.ar 1 UNL1111111111 -0.1481 25 C -3.6337 -2.4233 -1.9840 C.ar 1 UNL1111111111 -0.1430 26 C -4.7068 -1.5800 -1.8646 C.ar 1 UNL1111111111 -0.1681 27 C -6.0502 -0.0072 -0.5154 C.ar 1 UNL1111111111 -0.1552 28 C -5.3830 0.5027 1.7488 C.ar 1 UNL1111111111 -0.1471 29 C 4.3669 -0.4811 -1.9007 C.ar 1 UNL1111111111 -0.1516 30 C 3.6575 -1.5651 0.1464 C.ar 1 UNL1111111111 -0.1311 31 C -6.2747 0.6607 0.6598 C.ar 1 UNL1111111111 -0.1500 32 C 5.3853 0.1727 -1.2091 C.ar 1 UNL1111111111 -0.1767 33 C 4.6657 -0.9144 0.8524 C.ar 1 UNL1111111111 -0.1535 34 C 5.5097 -0.0609 0.1536 C.ar 1 UNL1111111111 0.0251 35 C -1.0590 4.9091 -0.4255 C.cat 1 UNL1111111111 0.5126 36 H -1.5323 0.0984 1.7014 H 1 UNL1111111111 0.1753 37 H -2.3873 -2.1590 2.3389 H 1 UNL1111111111 0.1516 38 H -1.2876 -2.9637 1.2039 H 1 UNL1111111111 0.1905 39 H -0.4352 0.8199 -1.5577 H 1 UNL1111111111 0.1390 40 H -1.4942 1.2244 -0.2003 H 1 UNL1111111111 0.1709 41 H 1.3183 -0.1741 -2.0367 H 1 UNL1111111111 0.1676 42 H 0.4605 1.7964 1.2569 H 1 UNL1111111111 0.1747 43 H 1.6082 1.2606 0.0403 H 1 UNL1111111111 0.1568 44 H 2.2748 -3.0892 -1.5916 H 1 UNL1111111111 0.1766 45 H 2.6751 -2.1742 -3.0515 H 1 UNL1111111111 0.1714 46 H 0.7626 3.0304 -1.5816 H 1 UNL1111111111 0.1298 47 H 1.3771 3.7336 -0.0534 H 1 UNL1111111111 0.1219 48 H -1.8786 -3.2497 -1.0302 H 1 UNL1111111111 0.1616 49 H -0.6695 -1.1557 -2.9400 H 1 UNL1111111111 0.2552 50 H -0.1126 -2.6776 -2.7674 H 1 UNL1111111111 0.2555 51 H -3.6121 -0.4392 2.4801 H 1 UNL1111111111 0.1527 52 H -3.4650 -2.9851 -2.9010 H 1 UNL1111111111 0.1516 53 H -5.4096 -1.4476 -2.6855 H 1 UNL1111111111 0.1547 54 H -0.6743 -2.4266 3.5738 H 1 UNL1111111111 0.3000 55 H 0.8321 -1.8672 4.1216 H 1 UNL1111111111 0.3096 56 H -6.7285 0.1039 -1.3590 H 1 UNL1111111111 0.1523 57 H -5.5862 1.0373 2.6745 H 1 UNL1111111111 0.1505 58 H 4.2440 -0.3121 -2.9686 H 1 UNL1111111111 0.1562 59 H 2.9741 -2.2377 0.6705 H 1 UNL1111111111 0.1828 60 H -7.1365 1.3155 0.7737 H 1 UNL1111111111 0.1500 61 H 6.0625 0.8441 -1.7307 H 1 UNL1111111111 0.1634 62 H 4.7768 -1.0732 1.9253 H 1 UNL1111111111 0.1741 63 H -2.8932 4.6308 0.4423 H 1 UNL1111111111 0.2990 64 H -2.8443 5.9200 -0.6263 H 1 UNL1111111111 0.2819 65 H 0.6752 5.7210 -1.2048 H 1 UNL1111111111 0.2894 66 H -0.4613 6.8684 -0.7794 H 1 UNL1111111111 0.2940 @BOND 1 1 34 1 2 2 13 2 3 3 17 2 4 4 10 1 5 4 12 1 6 4 13 am 7 5 14 1 8 5 49 1 9 5 50 1 10 6 17 am 11 6 54 1 12 6 55 1 13 7 20 1 14 7 35 2 15 8 35 1 16 8 63 1 17 8 64 1 18 9 35 1 19 9 65 1 20 9 66 1 21 10 11 1 22 10 17 1 23 10 36 1 24 11 15 1 25 11 37 1 26 11 38 1 27 12 16 1 28 12 39 1 29 12 40 1 30 13 14 1 31 14 18 1 32 14 41 1 33 15 19 ar 34 15 21 ar 35 16 20 1 36 16 42 1 37 16 43 1 38 18 23 1 39 18 44 1 40 18 45 1 41 19 22 ar 42 19 24 ar 43 20 46 1 44 20 47 1 45 21 25 ar 46 21 48 1 47 22 26 ar 48 22 27 ar 49 23 29 ar 50 23 30 ar 51 24 28 ar 52 24 51 1 53 25 26 ar 54 25 52 1 55 26 53 1 56 27 31 ar 57 27 56 1 58 28 31 ar 59 28 57 1 60 29 32 ar 61 29 58 1 62 30 33 ar 63 30 59 1 64 31 60 1 65 32 34 ar 66 32 61 1 67 33 34 ar 68 33 62 1