@MOLECULE (1s,4r)-bicyclo[2.2.1]heptan-2-one 18 19 0 0 0 SMALL GASTEIGER @ATOM 1 O -2.3065 -0.2422 -0.2263 O.2 1 UNL11111111 -0.4494 2 C 1.0066 1.0237 0.0657 C.3 1 UNL11111111 -0.0809 3 C -0.1203 -0.8744 0.6613 C.3 1 UNL11111111 -0.2081 4 C 0.7581 0.1963 1.3635 C.3 1 UNL11111111 -0.2867 5 C 1.5913 -0.0607 -0.8797 C.3 1 UNL11111111 -0.2848 6 C 0.8118 -1.3484 -0.4850 C.3 1 UNL11111111 -0.2625 7 C -0.4439 1.3145 -0.3974 C.3 1 UNL11111111 -0.4011 8 C -1.1579 0.0214 -0.0223 C.2 1 UNL11111111 0.4836 9 H 1.6317 1.9117 0.1783 H 1 UNL11111111 0.1365 10 H -0.5299 -1.6690 1.2876 H 1 UNL11111111 0.1589 11 H 0.2379 0.7513 2.1510 H 1 UNL11111111 0.1424 12 H 1.6743 -0.2130 1.8023 H 1 UNL11111111 0.1471 13 H 2.6722 -0.1821 -0.7230 H 1 UNL11111111 0.1384 14 H 1.4529 0.1962 -1.9381 H 1 UNL11111111 0.1401 15 H 0.2467 -1.7679 -1.3297 H 1 UNL11111111 0.1446 16 H 1.4905 -2.1397 -0.1356 H 1 UNL11111111 0.1425 17 H -0.5234 1.5305 -1.4727 H 1 UNL11111111 0.1703 18 H -0.8842 2.1794 0.1232 H 1 UNL11111111 0.1690 @BOND 1 1 8 2 2 2 4 1 3 2 5 1 4 2 7 1 5 2 9 1 6 3 4 1 7 3 6 1 8 3 8 1 9 3 10 1 10 4 11 1 11 4 12 1 12 5 6 1 13 5 13 1 14 5 14 1 15 6 15 1 16 6 16 1 17 7 8 1 18 7 17 1 19 7 18 1