@MOLECULE 1-[(1R)-2,2-dimethylcyclopropyl]-3,3-dimethyl-butan-1-one 32 32 0 0 0 SMALL USER_CHARGES @ATOM 1 C -2.0572 0.7153 1.3879 C.3 1 UNL11111111 -0.9675 2 C -2.3369 0.2659 -0.0525 C.3 1 UNL11111111 0.7034 3 C -3.0017 -1.1158 -0.0550 C.3 1 UNL11111111 -0.4686 4 C -3.2843 1.2811 -0.7222 C.3 1 UNL11111111 -0.4604 5 C -1.0236 0.2354 -0.8685 C.3 1 UNL11111111 -0.6094 6 C 0.0676 -0.6242 -0.2867 C.2 1 UNL11111111 1.2825 7 O -0.1154 -1.4696 0.5538 O.2 1 UNL11111111 -1.0623 8 C 1.4285 -0.3626 -0.8403 C.3 1 UNL11111111 -0.3396 9 H 1.4193 -0.0755 -1.8957 H 1 UNL11111111 0.2295 10 C 2.5947 -1.1824 -0.3274 C.3 1 UNL11111111 -0.3137 11 C 2.4924 0.2716 0.0665 C.3 1 UNL11111111 0.0355 12 C 3.4307 1.2658 -0.5715 C.3 1 UNL11111111 -0.7059 13 C 2.1431 0.6195 1.4897 C.3 1 UNL11111111 -0.5187 14 H -1.4393 -0.0220 1.9177 H 1 UNL11111111 0.2355 15 H -1.5331 1.6744 1.4181 H 1 UNL11111111 0.1531 16 H -2.9861 0.8244 1.9568 H 1 UNL11111111 0.3096 17 H -3.9443 -1.1060 0.5005 H 1 UNL11111111 0.0328 18 H -3.2152 -1.4623 -1.0698 H 1 UNL11111111 0.1150 19 H -2.3539 -1.8670 0.4197 H 1 UNL11111111 0.2128 20 H -2.8596 2.2891 -0.7213 H 1 UNL11111111 0.2138 21 H -3.4985 1.0071 -1.7594 H 1 UNL11111111 0.0651 22 H -4.2422 1.3294 -0.1936 H 1 UNL11111111 0.0470 23 H -1.2414 -0.1230 -1.8962 H 1 UNL11111111 0.2151 24 H -0.6467 1.2724 -0.9869 H 1 UNL11111111 0.0711 25 H 2.3992 -1.9553 0.4175 H 1 UNL11111111 0.2005 26 H 3.3621 -1.5139 -1.0184 H 1 UNL11111111 0.1338 27 H 3.7053 0.9881 -1.5960 H 1 UNL11111111 0.1973 28 H 2.9815 2.2664 -0.6121 H 1 UNL11111111 0.2958 29 H 4.3646 1.3476 0.0008 H 1 UNL11111111 0.1627 30 H 3.0404 0.6361 2.1224 H 1 UNL11111111 0.2306 31 H 1.6678 1.6056 1.5603 H 1 UNL11111111 0.1270 32 H 1.4513 -0.1101 1.9388 H 1 UNL11111111 0.1766 @BOND 1 1 2 1 2 2 3 1 3 2 4 1 4 2 5 1 5 5 6 1 6 6 7 2 7 6 8 1 8 8 9 1 9 8 10 1 10 10 11 1 11 8 11 1 12 11 12 1 13 11 13 1 14 1 14 1 15 1 15 1 16 1 16 1 17 3 17 1 18 3 18 1 19 3 19 1 20 4 20 1 21 4 21 1 22 4 22 1 23 5 23 1 24 5 24 1 25 10 25 1 26 10 26 1 27 12 27 1 28 12 28 1 29 12 29 1 30 13 30 1 31 13 31 1 32 13 32 1