@MOLECULE 1-methyl-3-pentylidyne-cyclobutane 27 27 0 0 0 SMALL USER_CHARGES @ATOM 1 C -1.8139 -0.8973 -0.6029 C.3 1 UNL111 -0.2815 2 C -3.2165 -0.2446 -0.3598 C.3 1 UNL111 -0.0796 3 C -4.0471 -0.9057 0.7193 C.3 1 UNL111 -0.4522 4 C -2.4899 1.0710 0.0807 C.3 1 UNL111 -0.2808 5 C -1.1535 0.3994 -0.1710 C.1 1 UNL111 -0.0458 6 C 0.0682 0.7784 -0.0503 C.1 1 UNL111 -0.1427 7 C 1.4409 1.1181 0.0741 C.3 1 UNL111 -0.2400 8 C 2.3213 -0.1466 -0.0524 C.3 1 UNL111 -0.2543 9 C 3.7996 0.1951 0.1652 C.3 1 UNL111 -0.2509 10 C 4.6612 -1.0654 0.0780 C.3 1 UNL111 -0.4390 11 H -1.5881 -1.7529 0.0396 H 1 UNL111 0.1502 12 H -1.6174 -1.1822 -1.6397 H 1 UNL111 0.1465 13 H -3.7956 -0.1211 -1.2885 H 1 UNL111 0.1329 14 H -3.4882 -1.0098 1.6580 H 1 UNL111 0.1500 15 H -4.9507 -0.3242 0.9395 H 1 UNL111 0.1459 16 H -4.3659 -1.9106 0.4161 H 1 UNL111 0.1461 17 H -2.6894 1.9369 -0.5563 H 1 UNL111 0.1467 18 H -2.6578 1.3617 1.1215 H 1 UNL111 0.1505 19 H 1.7425 1.8644 -0.6982 H 1 UNL111 0.1586 20 H 1.6359 1.6110 1.0575 H 1 UNL111 0.1602 21 H 1.9902 -0.9043 0.6822 H 1 UNL111 0.1431 22 H 2.1737 -0.6037 -1.0484 H 1 UNL111 0.1421 23 H 4.1343 0.9361 -0.5852 H 1 UNL111 0.1340 24 H 3.9380 0.6777 1.1516 H 1 UNL111 0.1342 25 H 4.3707 -1.8025 0.8356 H 1 UNL111 0.1433 26 H 4.5692 -1.5473 -0.9019 H 1 UNL111 0.1431 27 H 5.7207 -0.8346 0.2333 H 1 UNL111 0.1395 @BOND 1 1 2 1 2 2 3 1 3 2 4 1 4 4 5 1 5 1 5 1 6 5 6 3 7 6 7 1 8 7 8 1 9 8 9 1 10 9 10 1 11 1 11 1 12 1 12 1 13 2 13 1 14 3 14 1 15 3 15 1 16 3 16 1 17 4 17 1 18 4 18 1 19 7 19 1 20 7 20 1 21 8 21 1 22 8 22 1 23 9 23 1 24 9 24 1 25 10 25 1 26 10 26 1 27 10 27 1