@MOLECULE (1r,3s)-3-isopropyl-1-methylcyclopentanecarboxylic acid 30 30 0 0 0 SMALL GASTEIGER @ATOM 1 O -2.3275 -1.5363 -0.5760 O.3 1 UNL1111111111 -0.5710 2 O -2.2959 0.4307 -1.6041 O.2 1 UNL1111111111 -0.5138 3 C 1.2935 0.2704 0.4847 C.3 1 UNL1111111111 -0.1134 4 C -1.1964 0.1926 0.5845 C.3 1 UNL1111111111 0.0201 5 C 0.0840 -0.6701 0.6906 C.3 1 UNL1111111111 -0.2928 6 C 0.7073 1.5560 -0.1336 C.3 1 UNL1111111111 -0.2799 7 C -0.7207 1.6520 0.4166 C.3 1 UNL1111111111 -0.2825 8 C 2.3821 -0.3642 -0.4019 C.3 1 UNL1111111111 -0.0760 9 C -2.1108 0.0287 1.7960 C.3 1 UNL1111111111 -0.4559 10 C -1.9743 -0.2221 -0.6470 C.2 1 UNL1111111111 0.6225 11 C 3.5291 0.6273 -0.6380 C.3 1 UNL1111111111 -0.4535 12 C 2.9370 -1.6335 0.2584 C.3 1 UNL1111111111 -0.4556 13 H 1.7359 0.5150 1.4766 H 1 UNL1111111111 0.1340 14 H 0.0787 -1.4856 -0.0546 H 1 UNL1111111111 0.1562 15 H 0.1434 -1.1735 1.6689 H 1 UNL1111111111 0.1470 16 H 0.6928 1.4930 -1.2366 H 1 UNL1111111111 0.1488 17 H 1.3070 2.4424 0.1205 H 1 UNL1111111111 0.1370 18 H -0.7316 2.1768 1.3871 H 1 UNL1111111111 0.1444 19 H -1.3798 2.2312 -0.2543 H 1 UNL1111111111 0.1614 20 H 1.9335 -0.6361 -1.3879 H 1 UNL1111111111 0.1354 21 H -1.5908 0.2936 2.7250 H 1 UNL1111111111 0.1556 22 H -2.9994 0.6676 1.7241 H 1 UNL1111111111 0.1534 23 H -2.4582 -1.0093 1.8987 H 1 UNL1111111111 0.1654 24 H 3.9687 0.9651 0.3060 H 1 UNL1111111111 0.1427 25 H 4.3302 0.1698 -1.2288 H 1 UNL1111111111 0.1434 26 H 3.1895 1.5146 -1.1826 H 1 UNL1111111111 0.1442 27 H 3.3768 -1.4164 1.2374 H 1 UNL1111111111 0.1433 28 H 3.7184 -2.0895 -0.3593 H 1 UNL1111111111 0.1442 29 H 2.1573 -2.3878 0.4062 H 1 UNL1111111111 0.1434 30 H -2.8391 -1.8474 -1.3607 H 1 UNL1111111111 0.3516 @BOND 1 1 10 1 2 1 30 1 3 2 10 2 4 3 5 1 5 3 6 1 6 3 8 1 7 3 13 1 8 4 5 1 9 4 7 1 10 4 9 1 11 4 10 1 12 5 14 1 13 5 15 1 14 6 7 1 15 6 16 1 16 6 17 1 17 7 18 1 18 7 19 1 19 8 11 1 20 8 12 1 21 8 20 1 22 9 21 1 23 9 22 1 24 9 23 1 25 11 24 1 26 11 25 1 27 11 26 1 28 12 27 1 29 12 28 1 30 12 29 1