@MOLECULE (1-methylcyclobutyl) acetate 21 21 0 0 0 SMALL USER_CHARGES @ATOM 1 C 2.7455 -0.9457 0.3165 C.3 1 UNL11111111 -0.5139 2 C 1.6180 -0.0715 -0.1220 C.2 1 UNL11111111 0.6395 3 O 1.6550 0.8134 -0.9365 O.2 1 UNL11111111 -0.5158 4 O 0.4931 -0.4290 0.5419 O.3 1 UNL11111111 -0.4649 5 C -0.7187 0.2724 0.2928 C.3 1 UNL11111111 0.3175 6 C -0.6384 1.6731 0.8435 C.3 1 UNL11111111 -0.5015 7 C -1.2446 0.0930 -1.1576 C.3 1 UNL11111111 -0.3275 8 C -2.3867 -0.8108 -0.6236 C.3 1 UNL11111111 -0.2684 9 C -1.8513 -0.6551 0.8245 C.3 1 UNL11111111 -0.3189 10 H 3.6957 -0.6103 -0.1268 H 1 UNL11111111 0.1849 11 H 2.8563 -0.9440 1.4116 H 1 UNL11111111 0.1843 12 H 2.5763 -1.9906 0.0134 H 1 UNL11111111 0.1844 13 H 0.0931 2.2760 0.2822 H 1 UNL11111111 0.1787 14 H -1.6039 2.1886 0.7810 H 1 UNL11111111 0.1605 15 H -0.3251 1.6715 1.8950 H 1 UNL11111111 0.1605 16 H -1.5678 1.0170 -1.6414 H 1 UNL11111111 0.1540 17 H -0.5404 -0.4030 -1.8308 H 1 UNL11111111 0.1591 18 H -3.3904 -0.4098 -0.7807 H 1 UNL11111111 0.1400 19 H -2.3650 -1.8352 -1.0026 H 1 UNL11111111 0.1416 20 H -1.4839 -1.5820 1.2760 H 1 UNL11111111 0.1583 21 H -2.5357 -0.1803 1.5281 H 1 UNL11111111 0.1477 @BOND 1 1 2 1 2 2 3 2 3 2 4 1 4 4 5 1 5 5 6 1 6 5 7 1 7 7 8 1 8 8 9 1 9 5 9 1 10 1 10 1 11 1 11 1 12 1 12 1 13 6 13 1 14 6 14 1 15 6 15 1 16 7 16 1 17 7 17 1 18 8 18 1 19 8 19 1 20 9 20 1 21 9 21 1