@MOLECULE (1e)-1-penten-1-ylcyclohexane 31 31 0 0 0 SMALL USER_CHARGES @ATOM 1 C 5.2502 -0.3174 0.1995 C.3 1 UNL111111111 -0.4419 2 C 3.8417 -0.4875 -0.3675 C.3 1 UNL111111111 -0.2417 3 C 2.9070 0.6209 0.1441 C.3 1 UNL111111111 -0.2780 4 C 1.5299 0.4238 -0.4013 C.2 1 UNL111111111 -0.1618 5 C 0.4508 0.2970 0.3751 C.2 1 UNL111111111 -0.1893 6 C -0.9259 0.1023 -0.1838 C.3 1 UNL111111111 -0.1038 7 C -1.5130 -1.2267 0.3312 C.3 1 UNL111111111 -0.2708 8 C -2.9288 -1.4273 -0.2237 C.3 1 UNL111111111 -0.2638 9 C -3.8368 -0.2548 0.1719 C.3 1 UNL111111111 -0.2630 10 C -3.2471 1.0761 -0.3151 C.3 1 UNL111111111 -0.2636 11 C -1.8312 1.2756 0.2402 C.3 1 UNL111111111 -0.2711 12 H 5.6771 0.6556 -0.0683 H 1 UNL111111111 0.1422 13 H 5.2534 -0.3896 1.2928 H 1 UNL111111111 0.1427 14 H 5.9277 -1.0892 -0.1824 H 1 UNL111111111 0.1407 15 H 3.8730 -0.4761 -1.4731 H 1 UNL111111111 0.1339 16 H 3.4337 -1.4774 -0.0863 H 1 UNL111111111 0.1385 17 H 2.9103 0.6330 1.2517 H 1 UNL111111111 0.1432 18 H 3.2929 1.6149 -0.1630 H 1 UNL111111111 0.1457 19 H 1.4691 0.3898 -1.4874 H 1 UNL111111111 0.1429 20 H 0.5074 0.3278 1.4605 H 1 UNL111111111 0.1452 21 H -0.8937 0.0660 -1.3005 H 1 UNL111111111 0.1385 22 H -0.8607 -2.0661 0.0311 H 1 UNL111111111 0.1345 23 H -1.5332 -1.2315 1.4361 H 1 UNL111111111 0.1378 24 H -2.8929 -1.5208 -1.3251 H 1 UNL111111111 0.1349 25 H -3.3504 -2.3776 0.1505 H 1 UNL111111111 0.1292 26 H -4.8478 -0.3993 -0.2491 H 1 UNL111111111 0.1276 27 H -3.9621 -0.2304 1.2702 H 1 UNL111111111 0.1353 28 H -3.2259 1.0968 -1.4205 H 1 UNL111111111 0.1349 29 H -3.8955 1.9156 -0.0058 H 1 UNL111111111 0.1292 30 H -1.8623 1.3533 1.3421 H 1 UNL111111111 0.1379 31 H -1.4067 2.2282 -0.1240 H 1 UNL111111111 0.1342 @BOND 1 1 2 1 2 2 3 1 3 3 4 1 4 4 5 2 5 5 6 1 6 6 7 1 7 7 8 1 8 8 9 1 9 9 10 1 10 10 11 1 11 6 11 1 12 1 12 1 13 1 13 1 14 1 14 1 15 2 15 1 16 2 16 1 17 3 17 1 18 3 18 1 19 4 19 1 20 5 20 1 21 6 21 1 22 7 22 1 23 7 23 1 24 8 24 1 25 8 25 1 26 9 26 1 27 9 27 1 28 10 28 1 29 10 29 1 30 11 30 1 31 11 31 1