@MOLECULE n~6~-isopropyl-l-lysine 33 32 0 0 0 SMALL GASTEIGER @ATOM 1 C1 -4.9743 1.3568 -0.2833 C.3 1 <1> -0.5050 2 C2 -4.6239 -0.0403 0.2657 C.3 1 <1> 0.1002 3 C3 -5.6973 -1.0537 -0.1670 C.3 1 <1> -0.4617 4 N1 -3.3181 -0.5501 -0.2051 N.3 1 <1> -0.5728 5 C4 -2.1654 0.1743 0.3758 C.3 1 <1> -0.1074 6 C5 -0.8678 -0.4189 -0.2024 C.3 1 <1> -0.2884 7 C6 0.3509 0.2331 0.4557 C.3 1 <1> -0.2586 8 C7 1.6454 -0.2900 -0.1780 C.3 1 <1> -0.2758 9 C8 2.8726 0.3946 0.4545 C.3 1 <1> -0.0004 10 N2 2.8790 1.8342 0.1722 N.3 1 <1> -0.6243 11 C9 4.1313 -0.2760 -0.0906 C.2 1 <1> 0.5720 12 O1 4.9814 0.2186 -0.7818 O.2 1 <1> -0.5135 13 O2 4.2142 -1.5629 0.3206 O.3 1 <1> -0.5574 14 H1 -5.9603 1.6781 0.0682 H 1 <1> 0.1526 15 H2 -4.2500 2.1099 0.0407 H 1 <1> 0.1455 16 H3 -4.9975 1.3640 -1.3774 H 1 <1> 0.1482 17 H4 -4.5896 0.0008 1.3852 H 1 <1> 0.1328 18 H5 -5.4188 -2.0663 0.1550 H 1 <1> 0.1611 19 H6 -6.6676 -0.8129 0.2758 H 1 <1> 0.1441 20 H7 -5.8186 -1.0807 -1.2541 H 1 <1> 0.1448 21 H8 -2.2015 1.2688 0.1909 H 1 <1> 0.1118 22 H9 -0.8598 -1.5149 -0.0386 H 1 <1> 0.1553 23 H10 -0.8391 -0.2769 -1.2980 H 1 <1> 0.1365 24 H11 0.3044 1.3369 0.3544 H 1 <1> 0.1585 25 H12 0.3503 0.0351 1.5441 H 1 <1> 0.1404 26 H13 1.7200 -1.3879 -0.0356 H 1 <1> 0.1602 27 H14 1.6283 -0.1217 -1.2717 H 1 <1> 0.1469 28 H15 2.8472 0.2590 1.5723 H 1 <1> 0.1783 29 H16 3.7102 2.2905 0.5182 H 1 <1> 0.2621 30 H17 2.7861 2.0337 -0.8126 H 1 <1> 0.2615 31 H18 5.0171 -2.0389 -0.0088 H 1 <1> 0.3574 32 H19 -3.2725 -0.5611 -1.2207 H 1 <1> 0.2562 33 H20 -2.1918 0.0288 1.4783 H 1 <1> 0.1392 @BOND 1 1 14 1 2 1 15 1 3 1 16 1 4 2 4 1 5 2 1 1 6 2 17 1 7 3 2 1 8 3 18 1 9 3 19 1 10 3 20 1 11 4 32 1 12 5 4 1 13 5 21 1 14 5 33 1 15 6 5 1 16 6 22 1 17 6 23 1 18 7 6 1 19 7 24 1 20 7 25 1 21 8 7 1 22 8 26 1 23 8 27 1 24 9 11 1 25 9 8 1 26 9 28 1 27 10 9 1 28 10 29 1 29 10 30 1 30 11 12 2 31 11 13 1 32 13 31 1