@MOLECULE 3,5-dimethyl-3-heptene 27 26 0 0 0 SMALL USER_CHARGES @ATOM 1 C 3.1516 -1.2722 0.0822 C.3 1 UNL11111111 -0.4368 2 C 1.8458 -0.8314 -0.5767 C.3 1 UNL11111111 -0.2600 3 C 1.2407 0.4087 0.1176 C.3 1 UNL11111111 -0.0794 4 H 1.2552 0.2426 1.2224 H 1 UNL11111111 0.1368 5 C 2.0516 1.6764 -0.1865 C.3 1 UNL11111111 -0.4461 6 C -0.1651 0.5821 -0.3740 C.2 1 UNL11111111 -0.2425 7 C -1.2650 0.2706 0.3229 C.2 1 UNL11111111 0.0287 8 C -1.2420 -0.2759 1.7119 C.3 1 UNL11111111 -0.4543 9 C -2.6301 0.4651 -0.2754 C.3 1 UNL11111111 -0.2703 10 C -3.1488 -0.8571 -0.8482 C.3 1 UNL11111111 -0.4262 11 H 3.0089 -1.4990 1.1443 H 1 UNL11111111 0.1402 12 H 3.5513 -2.1726 -0.3970 H 1 UNL11111111 0.1392 13 H 3.9192 -0.4936 0.0113 H 1 UNL11111111 0.1427 14 H 2.0101 -0.6187 -1.6489 H 1 UNL11111111 0.1369 15 H 1.1123 -1.6605 -0.5433 H 1 UNL11111111 0.1370 16 H 2.1390 1.8511 -1.2635 H 1 UNL11111111 0.1433 17 H 1.5754 2.5588 0.2552 H 1 UNL11111111 0.1437 18 H 3.0649 1.6048 0.2215 H 1 UNL11111111 0.1419 19 H -0.2363 0.9803 -1.3845 H 1 UNL11111111 0.1480 20 H -1.0374 0.5222 2.4406 H 1 UNL11111111 0.1564 21 H -2.1954 -0.7404 1.9955 H 1 UNL11111111 0.1520 22 H -0.4651 -1.0429 1.8384 H 1 UNL11111111 0.1551 23 H -3.3345 0.8555 0.4855 H 1 UNL11111111 0.1425 24 H -2.6070 1.2343 -1.0732 H 1 UNL11111111 0.1417 25 H -4.1446 -0.7374 -1.2868 H 1 UNL11111111 0.1388 26 H -2.4815 -1.2353 -1.6319 H 1 UNL11111111 0.1468 27 H -3.2140 -1.6302 -0.0743 H 1 UNL11111111 0.1436 @BOND 1 1 2 1 2 2 3 1 3 3 4 1 4 3 5 1 5 3 6 1 6 6 7 2 7 7 8 1 8 7 9 1 9 9 10 1 10 1 11 1 11 1 12 1 12 1 13 1 13 2 14 1 14 2 15 1 15 5 16 1 16 5 17 1 17 5 18 1 18 6 19 1 19 8 20 1 20 8 21 1 21 8 22 1 22 9 23 1 23 9 24 1 24 10 25 1 25 10 26 1 26 10 27 1