@MOLECULE 3-(aminomethyl)-1-iodo-5,6,7,8-tetrahydro-2-naphthalenol 28 29 0 0 0 SMALL USER_CHARGES @ATOM 1 I -2.1188 -0.0810 -0.0143 I 1 UNL111111 0.0074 2 O -0.2868 2.4568 -0.1850 O.3 1 UNL111111 -0.4816 3 N 1.9599 3.9015 0.6301 N.3 1 UNL111111 -0.6553 4 C 2.5191 -3.2984 -0.3733 C.3 1 UNL111111 -0.2610 5 C 1.2651 -3.4854 0.4788 C.3 1 UNL111111 -0.2583 6 C 3.1778 -1.9730 0.0157 C.3 1 UNL111111 -0.2593 7 C 0.2408 -2.3883 0.1615 C.3 1 UNL111111 -0.2810 8 C 2.2112 -0.8273 -0.0149 C.ar 1 UNL111111 -0.0726 9 C 0.8213 -1.0082 0.0480 C.ar 1 UNL111111 0.0670 10 C 2.7557 0.4543 -0.1089 C.ar 1 UNL111111 -0.1222 11 C -0.0071 0.1191 -0.0230 C.ar 1 UNL111111 -0.2091 12 C 1.9446 1.5795 -0.1618 C.ar 1 UNL111111 -0.1895 13 C 0.5507 1.4032 -0.1160 C.ar 1 UNL111111 0.3100 14 C 2.5591 2.9397 -0.3333 C.3 1 UNL111111 -0.0915 15 H 2.2583 -3.2969 -1.4486 H 1 UNL111111 0.1435 16 H 3.2225 -4.1374 -0.2288 H 1 UNL111111 0.1322 17 H 1.5299 -3.4576 1.5535 H 1 UNL111111 0.1415 18 H 0.8163 -4.4800 0.3018 H 1 UNL111111 0.1344 19 H 4.0349 -1.7731 -0.6599 H 1 UNL111111 0.1429 20 H 3.6120 -2.0544 1.0358 H 1 UNL111111 0.1494 21 H -0.5415 -2.4198 0.9511 H 1 UNL111111 0.1593 22 H -0.2731 -2.6390 -0.7942 H 1 UNL111111 0.1616 23 H 3.8399 0.5700 -0.1493 H 1 UNL111111 0.1545 24 H 3.6668 2.8867 -0.2421 H 1 UNL111111 0.1253 25 H 2.3450 3.3150 -1.3653 H 1 UNL111111 0.1562 26 H 0.1902 3.3264 0.0114 H 1 UNL111111 0.3792 27 H 2.3473 4.8254 0.5261 H 1 UNL111111 0.2562 28 H 2.0867 3.5965 1.5839 H 1 UNL111111 0.2604 @BOND 1 15 4 1 2 25 14 1 3 22 7 1 4 19 6 1 5 4 16 1 6 4 6 1 7 4 5 1 8 14 24 1 9 14 12 1 10 14 3 1 11 2 13 1 12 2 26 1 13 12 13 ar 14 12 10 ar 15 23 10 1 16 13 11 ar 17 10 8 ar 18 11 1 1 19 11 9 ar 20 8 6 1 21 8 9 ar 22 6 20 1 23 9 7 1 24 7 5 1 25 7 21 1 26 18 5 1 27 5 17 1 28 27 3 1 29 3 28 1