@MOLECULE (3aR,5aS)-1,2,3,3a,5a,6,7,8-octahydropyrene 34 37 0 0 0 SMALL USER_CHARGES @ATOM 1 C 0.7019 0.0327 0.1308 C.ar 1 UNL11111111 -0.0476 2 C 1.4281 -1.2744 0.3267 C.3 1 UNL11111111 0.1041 3 C 1.4025 1.2290 -0.0291 C.ar 1 UNL11111111 0.1254 4 C 2.8986 1.2898 -0.1022 C.3 1 UNL11111111 -0.4340 5 C 3.5801 -0.0010 0.3649 C.3 1 UNL11111111 -0.3855 6 C 2.8599 -1.2122 -0.2300 C.3 1 UNL11111111 -0.4285 7 C 0.6670 -2.4092 -0.2925 C.2 1 UNL11111111 -0.3123 8 C -0.6683 -2.4091 -0.2917 C.2 1 UNL11111111 -0.3635 9 C -1.4287 -1.2737 0.3268 C.3 1 UNL11111111 0.1956 10 C -0.7019 0.0329 0.1309 C.ar 1 UNL11111111 -0.1015 11 C 0.6940 2.4270 -0.1680 C.ar 1 UNL11111111 -0.3383 12 C -0.6934 2.4271 -0.1673 C.ar 1 UNL11111111 -0.3352 13 C -1.4022 1.2295 -0.0283 C.ar 1 UNL11111111 0.1382 14 C -2.8986 1.2905 -0.1007 C.3 1 UNL11111111 -0.4320 15 C -3.5797 -0.0012 0.3648 C.3 1 UNL11111111 -0.3892 16 C -2.8593 -1.2112 -0.2322 C.3 1 UNL11111111 -0.4627 17 H 3.2772 2.1449 0.4946 H 1 UNL11111111 0.1895 18 H 4.6446 0.0009 0.0675 H 1 UNL11111111 0.1780 19 H 2.8328 -1.1385 -1.3339 H 1 UNL11111111 0.2104 20 H 1.2571 -3.2109 -0.7224 H 1 UNL11111111 0.2104 21 H -1.2595 -3.2104 -0.7209 H 1 UNL11111111 0.2169 22 H 1.2337 3.3646 -0.2827 H 1 UNL11111111 0.2097 23 H -1.2331 3.3647 -0.2820 H 1 UNL11111111 0.2085 24 H -3.1911 1.5061 -1.1519 H 1 UNL11111111 0.1945 25 H -4.6442 0.0006 0.0683 H 1 UNL11111111 0.1831 26 H -3.4030 -2.1435 0.0013 H 1 UNL11111111 0.1815 27 H 1.4844 -1.4602 1.4370 H 1 UNL11111111 0.1557 28 H 3.1905 1.5052 -1.1538 H 1 UNL11111111 0.1953 29 H 3.5719 -0.0568 1.4700 H 1 UNL11111111 0.2073 30 H 3.4032 -2.1439 0.0067 H 1 UNL11111111 0.1767 31 H -1.4865 -1.4589 1.4370 H 1 UNL11111111 0.1396 32 H -3.2768 2.1450 0.4969 H 1 UNL11111111 0.1876 33 H -3.5705 -0.0597 1.4697 H 1 UNL11111111 0.2074 34 H -2.8299 -1.1357 -1.3358 H 1 UNL11111111 0.2150 @BOND 1 34 16 1 2 19 6 1 3 28 4 1 4 24 14 1 5 20 7 1 6 21 8 1 7 7 8 2 8 7 2 1 9 8 9 1 10 22 11 1 11 23 12 1 12 16 26 1 13 16 9 1 14 16 15 1 15 6 30 1 16 6 2 1 17 6 5 1 18 11 12 ar 19 11 3 ar 20 12 13 ar 21 4 3 1 22 4 5 1 23 4 17 1 24 14 13 1 25 14 15 1 26 14 32 1 27 3 1 ar 28 13 10 ar 29 18 5 1 30 25 15 1 31 1 10 ar 32 1 2 1 33 10 9 1 34 2 27 1 35 9 31 1 36 15 33 1 37 5 29 1