@MOLECULE n~6~-(dichloroacetyl)-l-lysine 29 28 0 0 0 SMALL GASTEIGER @ATOM 1 Cl1 -3.5463 -1.0381 -0.1723 Cl 1 <1> -0.0264 2 Cl2 -0.7248 -1.4564 -0.4738 Cl 1 <1> -0.1059 3 O1 1.7639 -0.2461 1.7482 O.3 1 <1> -0.5914 4 O2 1.9730 -2.2782 0.8772 O.2 1 <1> -0.4892 5 O3 -2.4987 1.6080 -0.4675 O.2 1 <1> -0.4577 6 N1 -0.6210 1.4177 0.8026 N.am 1 <1> -0.5808 7 N2 3.3018 -1.3637 -1.3919 N.3 1 <1> -0.6224 8 C1 2.1076 2.0288 -0.2187 C.3 1 <1> -0.2704 9 C2 2.0576 0.7155 -1.0095 C.3 1 <1> -0.2842 10 C3 0.8866 2.9080 -0.5257 C.3 1 <1> -0.3036 11 C4 2.9104 -0.3899 -0.3639 C.3 1 <1> 0.0029 12 C5 -0.2084 2.8052 0.5537 C.3 1 <1> -0.0648 13 C6 2.1735 -1.0994 0.7681 C.2 1 <1> 0.5747 14 C7 -1.7356 0.9168 0.1665 C.2 1 <1> 0.5275 15 C8 -1.9717 -0.5696 0.4165 C.3 1 <1> -0.1230 16 H1 3.0375 2.5752 -0.4692 H 1 <1> 0.1403 17 H2 2.1771 1.8350 0.8699 H 1 <1> 0.1552 18 H3 1.0158 0.3798 -1.1502 H 1 <1> 0.1548 19 H4 2.4362 0.8954 -2.0417 H 1 <1> 0.1728 20 H5 0.4595 2.6504 -1.5150 H 1 <1> 0.1580 21 H6 1.1958 3.9674 -0.6130 H 1 <1> 0.1445 22 H7 3.8516 0.0595 0.0640 H 1 <1> 0.1774 23 H8 -1.0963 3.4116 0.2519 H 1 <1> 0.1663 24 H9 0.1572 3.2258 1.5187 H 1 <1> 0.1421 25 H10 0.1147 0.8082 1.1442 H 1 <1> 0.3268 26 H11 2.5056 -1.7488 -1.8801 H 1 <1> 0.2647 27 H12 3.8478 -2.1250 -1.0142 H 1 <1> 0.2656 28 H13 -1.9016 -0.8636 1.4836 H 1 <1> 0.1865 29 H14 1.4057 -0.7080 2.5476 H 1 <1> 0.3597 @BOND 1 1 15 1 2 2 15 1 3 3 13 1 4 3 29 1 5 4 13 2 6 5 14 2 7 6 12 1 8 6 14 am 9 6 25 1 10 7 11 1 11 7 26 1 12 7 27 1 13 8 9 1 14 8 10 1 15 8 16 1 16 8 17 1 17 9 11 1 18 9 18 1 19 9 19 1 20 10 12 1 21 10 20 1 22 10 21 1 23 11 13 1 24 11 22 1 25 12 23 1 26 12 24 1 27 14 15 1 28 15 28 1