@MOLECULE trans-1,4-cyclohexanedicarboxylic acid 24 24 0 0 0 SMALL GASTEIGER @ATOM 1 O -3.5868 -0.7246 0.8218 O.3 1 UNL1111 -0.5701 2 O 3.5866 -0.7244 -0.8222 O.3 1 UNL1111 -0.5701 3 O -3.4006 0.5959 -0.9599 O.2 1 UNL1111 -0.5056 4 O 3.4009 0.5956 0.9598 O.2 1 UNL1111 -0.5056 5 C -0.7444 1.3216 -0.1773 C.3 1 UNL1111 -0.2647 6 C 0.7443 1.3218 0.1775 C.3 1 UNL1111 -0.2647 7 C -0.7441 -1.2109 -0.1808 C.3 1 UNL1111 -0.2600 8 C 0.7442 -1.2107 0.1809 C.3 1 UNL1111 -0.2600 9 C -2.8652 0.0461 -0.0350 C.2 1 UNL1111 0.6243 10 C 2.8652 0.0461 0.0349 C.2 1 UNL1111 0.6243 11 C -1.4178 0.0562 0.3737 C.3 1 UNL1111 -0.1718 12 C 1.4178 0.0564 -0.3735 C.3 1 UNL1111 -0.1718 13 H -4.5486 -0.7758 0.6014 H 1 UNL1111 0.3560 14 H 4.5485 -0.7755 -0.6022 H 1 UNL1111 0.3560 15 H -1.2351 2.2275 0.2286 H 1 UNL1111 0.1493 16 H -0.8831 1.3809 -1.2764 H 1 UNL1111 0.1602 17 H 1.2350 2.2277 -0.2282 H 1 UNL1111 0.1493 18 H 0.8828 1.3809 1.2767 H 1 UNL1111 0.1602 19 H -0.8705 -1.2655 -1.2802 H 1 UNL1111 0.1515 20 H -1.2348 -2.1155 0.2303 H 1 UNL1111 0.1527 21 H 0.8706 -1.2653 1.2803 H 1 UNL1111 0.1515 22 H 1.2352 -2.1152 -0.2302 H 1 UNL1111 0.1527 23 H -1.3465 0.0488 1.4927 H 1 UNL1111 0.1782 24 H 1.3465 0.0491 -1.4925 H 1 UNL1111 0.1782 @BOND 1 1 13 1 2 2 14 1 3 3 9 2 4 4 10 2 5 5 11 1 6 5 15 1 7 5 16 1 8 6 5 1 9 6 12 1 10 6 17 1 11 6 18 1 12 7 19 1 13 7 20 1 14 8 7 1 15 8 21 1 16 8 22 1 17 9 1 1 18 10 2 1 19 10 12 1 20 11 7 1 21 11 9 1 22 11 23 1 23 12 8 1 24 12 24 1