@MOLECULE (1r,2s,4r)-4-ethyl-1,2-dimethylcyclopentane 27 27 0 0 0 SMALL USER_CHARGES @ATOM 1 C -0.9774 0.4819 -0.3916 C.3 1 UNL11111111 -0.0948 2 C 1.0897 -0.9165 -0.4976 C.3 1 UNL11111111 -0.0896 3 C 1.4679 0.5875 -0.4782 C.3 1 UNL11111111 -0.0905 4 C -0.4364 -0.9220 -0.7554 C.3 1 UNL11111111 -0.3002 5 C 0.2356 1.2840 0.1289 C.3 1 UNL11111111 -0.3003 6 C -2.0961 0.4308 0.6579 C.3 1 UNL11111111 -0.2686 7 C 1.4162 -1.6447 0.8076 C.3 1 UNL11111111 -0.4481 8 C 2.7513 0.9151 0.2766 C.3 1 UNL11111111 -0.4519 9 C -3.3878 -0.1423 0.0745 C.3 1 UNL11111111 -0.4369 10 H -1.3688 0.9700 -1.3121 H 1 UNL11111111 0.1288 11 H 1.6232 -1.4231 -1.3304 H 1 UNL11111111 0.1240 12 H 1.5852 0.9235 -1.5366 H 1 UNL11111111 0.1279 13 H -0.6493 -1.1528 -1.8107 H 1 UNL11111111 0.1300 14 H -0.9347 -1.7087 -0.1684 H 1 UNL11111111 0.1425 15 H 0.2828 1.2603 1.2301 H 1 UNL11111111 0.1403 16 H 0.1790 2.3431 -0.1570 H 1 UNL11111111 0.1315 17 H -2.2842 1.4493 1.0490 H 1 UNL11111111 0.1347 18 H -1.7715 -0.1705 1.5279 H 1 UNL11111111 0.1373 19 H 0.9458 -1.1501 1.6649 H 1 UNL11111111 0.1467 20 H 2.4954 -1.6770 0.9902 H 1 UNL11111111 0.1421 21 H 1.0573 -2.6793 0.7832 H 1 UNL11111111 0.1391 22 H 2.6643 0.6968 1.3468 H 1 UNL11111111 0.1468 23 H 3.0023 1.9776 0.1807 H 1 UNL11111111 0.1416 24 H 3.5977 0.3374 -0.1112 H 1 UNL11111111 0.1433 25 H -3.7661 0.4782 -0.7455 H 1 UNL11111111 0.1418 26 H -4.1742 -0.2013 0.8347 H 1 UNL11111111 0.1396 27 H -3.2352 -1.1524 -0.3219 H 1 UNL11111111 0.1429 @BOND 1 13 4 1 2 12 3 1 3 11 2 1 4 10 1 1 5 4 2 1 6 4 1 1 7 4 14 1 8 25 9 1 9 2 3 1 10 2 7 1 11 3 5 1 12 3 8 1 13 1 5 1 14 1 6 1 15 27 9 1 16 16 5 1 17 24 8 1 18 9 6 1 19 9 26 1 20 5 15 1 21 23 8 1 22 8 22 1 23 6 17 1 24 6 18 1 25 21 7 1 26 7 20 1 27 7 19 1