@MOLECULE (1S,2S)-1-iodo-2-methyl-cyclobutane 15 15 0 0 0 SMALL USER_CHARGES @ATOM 1 C 1.9963 0.4671 -0.4040 C.3 1 UNL111111 -0.0921 2 H 1.5871 0.8101 -1.3706 H 1 UNL111111 0.1497 3 C 2.8528 1.5482 0.2208 C.3 1 UNL111111 -0.4553 4 C 2.6720 -0.9333 -0.5163 C.3 1 UNL111111 -0.2886 5 C 1.5692 -1.5457 0.3847 C.3 1 UNL111111 -0.2873 6 C 0.9417 -0.1432 0.5689 C.3 1 UNL111111 -0.1458 7 H 0.9963 0.2433 1.5956 H 1 UNL111111 0.1564 8 I -1.1171 0.0578 -0.0316 I 1 UNL111111 -0.0942 9 H 3.6920 1.8156 -0.4349 H 1 UNL111111 0.1545 10 H 2.2732 2.4632 0.3996 H 1 UNL111111 0.1533 11 H 3.2804 1.2370 1.1817 H 1 UNL111111 0.1505 12 H 2.7067 -1.3366 -1.5309 H 1 UNL111111 0.1459 13 H 3.6801 -0.9850 -0.0984 H 1 UNL111111 0.1478 14 H 0.9523 -2.2984 -0.1142 H 1 UNL111111 0.1562 15 H 1.9336 -1.9902 1.3165 H 1 UNL111111 0.1490 @BOND 1 12 4 1 2 2 1 1 3 4 1 1 4 4 13 1 5 4 5 1 6 9 3 1 7 1 3 1 8 1 6 1 9 14 5 1 10 8 6 1 11 3 10 1 12 3 11 1 13 5 6 1 14 5 15 1 15 6 7 1