@MOLECULE 3,3-dimethylbutanoyl 1-methylcyclobutanecarboxylate 35 35 0 0 0 SMALL USER_CHARGES @ATOM 1 C -2.7608 -1.2269 -0.8535 C.3 1 UNL11111111 -0.2722 2 C -3.9419 -0.4043 -1.4293 C.3 1 UNL11111111 -0.2767 3 C -3.8714 0.5555 -0.2145 C.3 1 UNL11111111 -0.2767 4 C -2.6787 -0.2636 0.3679 C.3 1 UNL11111111 -0.0112 5 C -2.9170 -0.9007 1.7201 C.3 1 UNL11111111 -0.4499 6 C -1.4172 0.5526 0.4281 C.2 1 UNL11111111 0.6229 7 O -1.2900 1.7082 0.7021 O.2 1 UNL11111111 -0.4371 8 O -0.3314 -0.2648 0.2077 O.3 1 UNL11111111 -0.5602 9 C 0.8888 0.2237 -0.2255 C.2 1 UNL11111111 0.6493 10 O 0.9623 1.2594 -0.8146 O.2 1 UNL11111111 -0.4385 11 C 1.9231 -0.8047 0.0982 C.3 1 UNL11111111 -0.3809 12 C 3.3711 -0.2653 0.0030 C.3 1 UNL11111111 0.1551 13 C 3.5440 0.9465 0.9258 C.3 1 UNL11111111 -0.4756 14 C 4.3180 -1.3915 0.4551 C.3 1 UNL11111111 -0.4716 15 C 3.7016 0.1231 -1.4426 C.3 1 UNL11111111 -0.4753 16 H -3.0052 -2.2591 -0.5922 H 1 UNL11111111 0.1460 17 H -1.8656 -1.2452 -1.4818 H 1 UNL11111111 0.1541 18 H -3.7354 0.0699 -2.3927 H 1 UNL11111111 0.1455 19 H -4.8799 -0.9565 -1.5187 H 1 UNL11111111 0.1399 20 H -3.6313 1.5951 -0.4629 H 1 UNL11111111 0.1611 21 H -4.7618 0.5612 0.4183 H 1 UNL11111111 0.1486 22 H -3.8400 -1.4950 1.7259 H 1 UNL11111111 0.1578 23 H -2.0941 -1.5745 1.9972 H 1 UNL11111111 0.1602 24 H -3.0127 -0.1463 2.5133 H 1 UNL11111111 0.1603 25 H 1.7401 -1.2131 1.1166 H 1 UNL11111111 0.1816 26 H 1.7950 -1.6712 -0.5866 H 1 UNL11111111 0.1801 27 H 3.2766 0.7131 1.9608 H 1 UNL11111111 0.1450 28 H 4.5800 1.3020 0.9243 H 1 UNL11111111 0.1497 29 H 2.9179 1.7904 0.6033 H 1 UNL11111111 0.1682 30 H 4.2198 -2.2801 -0.1759 H 1 UNL11111111 0.1435 31 H 5.3637 -1.0685 0.4004 H 1 UNL11111111 0.1505 32 H 4.1258 -1.6917 1.4900 H 1 UNL11111111 0.1448 33 H 3.0660 0.9497 -1.7918 H 1 UNL11111111 0.1720 34 H 4.7397 0.4590 -1.5352 H 1 UNL11111111 0.1479 35 H 3.5627 -0.7135 -2.1330 H 1 UNL11111111 0.1418 @BOND 1 1 2 1 2 2 3 1 3 3 4 1 4 1 4 1 5 4 5 1 6 4 6 1 7 6 7 2 8 6 8 1 9 8 9 1 10 9 10 2 11 9 11 1 12 11 12 1 13 12 13 1 14 12 14 1 15 12 15 1 16 1 16 1 17 1 17 1 18 2 18 1 19 2 19 1 20 3 20 1 21 3 21 1 22 5 22 1 23 5 23 1 24 5 24 1 25 11 25 1 26 11 26 1 27 13 27 1 28 13 28 1 29 13 29 1 30 14 30 1 31 14 31 1 32 14 32 1 33 15 33 1 34 15 34 1 35 15 35 1