@MOLECULE 1-butoxy-2,2-dimethyl-butane 33 32 0 0 0 SMALL USER_CHARGES @ATOM 1 C 5.2002 0.6345 -0.0017 C.3 1 UNL11111111 -0.4365 2 C 4.0962 -0.4230 0.0042 C.3 1 UNL11111111 -0.2486 3 C 2.7136 0.2355 -0.0005 C.3 1 UNL11111111 -0.2921 4 C 1.6163 -0.8336 -0.0011 C.3 1 UNL11111111 -0.0471 5 O 0.4092 -0.0823 -0.0048 O.3 1 UNL11111111 -0.3994 6 C -0.7486 -0.9052 0.0036 C.3 1 UNL11111111 -0.0784 7 C -1.9440 0.0829 0.0018 C.3 1 UNL11111111 0.0931 8 C -1.8611 0.9600 1.2562 C.3 1 UNL11111111 -0.4559 9 C -1.8622 0.9538 -1.2572 C.3 1 UNL11111111 -0.4557 10 C -3.2322 -0.7734 0.0023 C.3 1 UNL11111111 -0.2818 11 C -4.5131 0.0601 -0.0015 C.3 1 UNL11111111 -0.4290 12 H 5.1362 1.2871 0.8765 H 1 UNL11111111 0.1442 13 H 6.1932 0.1722 0.0031 H 1 UNL11111111 0.1395 14 H 5.1376 1.2718 -0.8912 H 1 UNL11111111 0.1441 15 H 4.2055 -1.0843 -0.8767 H 1 UNL11111111 0.1333 16 H 4.2035 -1.0770 0.8906 H 1 UNL11111111 0.1334 17 H 2.5893 0.8976 0.8780 H 1 UNL11111111 0.1516 18 H 2.5939 0.8932 -0.8827 H 1 UNL11111111 0.1515 19 H 1.6594 -1.4696 -0.9016 H 1 UNL11111111 0.1130 20 H 1.6567 -1.4671 0.9014 H 1 UNL11111111 0.1130 21 H -0.7512 -1.5450 -0.8943 H 1 UNL11111111 0.1137 22 H -0.7460 -1.5345 0.9089 H 1 UNL11111111 0.1138 23 H -0.8784 1.4476 1.3216 H 1 UNL11111111 0.1612 24 H -2.6196 1.7486 1.2465 H 1 UNL11111111 0.1428 25 H -1.9957 0.3741 2.1703 H 1 UNL11111111 0.1398 26 H -1.9847 0.3594 -2.1673 H 1 UNL11111111 0.1399 27 H -2.6286 1.7347 -1.2584 H 1 UNL11111111 0.1426 28 H -0.8850 1.4519 -1.3200 H 1 UNL11111111 0.1611 29 H -3.2283 -1.4403 -0.8813 H 1 UNL11111111 0.1337 30 H -3.2309 -1.4388 0.8870 H 1 UNL11111111 0.1337 31 H -4.5807 0.6977 0.8870 H 1 UNL11111111 0.1442 32 H -4.5667 0.7118 -0.8808 H 1 UNL11111111 0.1444 33 H -5.3997 -0.5834 -0.0140 H 1 UNL11111111 0.1366 @BOND 1 1 2 1 2 2 3 1 3 3 4 1 4 4 5 1 5 5 6 1 6 6 7 1 7 7 8 1 8 7 9 1 9 7 10 1 10 10 11 1 11 1 12 1 12 1 13 1 13 1 14 1 14 2 15 1 15 2 16 1 16 3 17 1 17 3 18 1 18 4 19 1 19 4 20 1 20 6 21 1 21 6 22 1 22 8 23 1 23 8 24 1 24 8 25 1 25 9 26 1 26 9 27 1 27 9 28 1 28 10 29 1 29 10 30 1 30 11 31 1 31 11 32 1 32 11 33 1