@MOLECULE [(E)-hept-1-enyl]cyclobutane 31 31 0 0 0 SMALL USER_CHARGES @ATOM 1 C 5.7452 -0.3599 0.3708 C.3 1 UNL1111111 -0.4401 2 C 4.3779 -0.6932 -0.2266 C.3 1 UNL1111111 -0.2506 3 C 3.3155 0.3132 0.2357 C.3 1 UNL1111111 -0.2736 4 C 1.9453 -0.0308 -0.3613 C.3 1 UNL1111111 -0.2638 5 C 0.8725 0.9493 0.1398 C.3 1 UNL1111111 -0.2798 6 C -0.4398 0.6605 -0.5144 C.2 1 UNL1111111 -0.1563 7 C -1.5530 0.3885 0.1729 C.2 1 UNL1111111 -0.1828 8 C -2.8509 0.0966 -0.4855 C.3 1 UNL1111111 -0.1137 9 C -3.4263 -1.3147 -0.1412 C.3 1 UNL1111111 -0.2790 10 C -4.6634 -0.6529 0.5183 C.3 1 UNL1111111 -0.2745 11 C -4.0881 0.7521 0.2045 C.3 1 UNL1111111 -0.2815 12 H 5.7194 -0.3799 1.4661 H 1 UNL1111111 0.1424 13 H 6.5056 -1.0787 0.0462 H 1 UNL1111111 0.1401 14 H 6.0838 0.6366 0.0670 H 1 UNL1111111 0.1420 15 H 4.4391 -0.6982 -1.3312 H 1 UNL1111111 0.1336 16 H 4.0793 -1.7179 0.0652 H 1 UNL1111111 0.1342 17 H 3.2585 0.3200 1.3400 H 1 UNL1111111 0.1370 18 H 3.6126 1.3368 -0.0585 H 1 UNL1111111 0.1361 19 H 1.9962 -0.0077 -1.4656 H 1 UNL1111111 0.1371 20 H 1.6592 -1.0652 -0.0926 H 1 UNL1111111 0.1408 21 H 0.7998 0.8938 1.2438 H 1 UNL1111111 0.1433 22 H 1.1778 1.9928 -0.0846 H 1 UNL1111111 0.1475 23 H -0.4243 0.6898 -1.6025 H 1 UNL1111111 0.1434 24 H -1.5679 0.3556 1.2609 H 1 UNL1111111 0.1477 25 H -2.8241 0.2878 -1.5724 H 1 UNL1111111 0.1387 26 H -3.6473 -1.9317 -1.0134 H 1 UNL1111111 0.1371 27 H -2.8056 -1.8991 0.5416 H 1 UNL1111111 0.1425 28 H -5.6118 -0.8732 0.0232 H 1 UNL1111111 0.1365 29 H -4.7784 -0.8679 1.5830 H 1 UNL1111111 0.1373 30 H -3.8507 1.3523 1.0853 H 1 UNL1111111 0.1413 31 H -4.7021 1.3588 -0.4631 H 1 UNL1111111 0.1373 @BOND 1 1 2 1 2 2 3 1 3 3 4 1 4 4 5 1 5 5 6 1 6 6 7 2 7 7 8 1 8 8 9 1 9 9 10 1 10 10 11 1 11 8 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 4 20 1 21 5 21 1 22 5 22 1 23 6 23 1 24 7 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