@MOLECULE lecanoricacid 37 38 0 0 0 SMALL GASTEIGER @ATOM 1 O -0.4814 0.0145 0.6150 O.3 1 UNL1111111111 -0.4155 2 O 3.5402 -2.3909 0.0514 O.3 1 UNL1111111111 -0.4458 3 O -2.7095 -2.3815 -0.2089 O.3 1 UNL1111111111 -0.4492 4 O -6.6856 0.0962 0.5220 O.3 1 UNL1111111111 -0.4579 5 O -0.6892 0.0274 -1.6255 O.2 1 UNL1111111111 -0.4456 6 O 5.7283 -0.0289 1.0674 O.3 1 UNL1111111111 -0.5494 7 O 5.6959 0.0297 -1.1536 O.2 1 UNL1111111111 -0.4865 8 C -2.6509 0.0144 -0.2441 C.ar 1 UNL1111111111 -0.4061 9 C 2.9350 1.2256 0.2018 C.ar 1 UNL1111111111 0.2090 10 C -3.3379 1.2437 -0.1282 C.ar 1 UNL1111111111 0.2371 11 C 3.6222 0.0063 0.0868 C.ar 1 UNL1111111111 -0.3555 12 C 0.8900 -0.0003 0.4230 C.ar 1 UNL1111111111 0.3420 13 C 1.5553 1.2299 0.3830 C.ar 1 UNL1111111111 -0.3277 14 C 2.9197 -1.2031 0.1605 C.ar 1 UNL1111111111 0.3930 15 C -3.3454 -1.1997 -0.1036 C.ar 1 UNL1111111111 0.4286 16 C 1.5323 -1.2260 0.3331 C.ar 1 UNL1111111111 -0.3456 17 C -4.7027 1.2357 0.1257 C.ar 1 UNL1111111111 -0.3675 18 C -1.2241 0.0313 -0.5515 C.2 1 UNL1111111111 0.6227 19 C 3.6862 2.5077 0.1244 C.3 1 UNL1111111111 -0.4764 20 C -5.3639 0.0056 0.2633 C.ar 1 UNL1111111111 0.4007 21 C -4.7164 -1.2292 0.1508 C.ar 1 UNL1111111111 -0.4459 22 C -2.5964 2.5239 -0.2764 C.3 1 UNL1111111111 -0.4786 23 C 5.0727 0.0176 -0.1236 C.2 1 UNL1111111111 0.6525 24 H 0.9914 2.1522 0.4734 H 1 UNL1111111111 0.1791 25 H 0.9872 -2.1627 0.3773 H 1 UNL1111111111 0.1944 26 H -5.2699 2.1579 0.2230 H 1 UNL1111111111 0.1883 27 H 4.4333 2.5843 0.9319 H 1 UNL1111111111 0.1761 28 H 4.2309 2.5977 -0.8314 H 1 UNL1111111111 0.1799 29 H 3.0380 3.3911 0.2044 H 1 UNL1111111111 0.1652 30 H -5.2390 -2.1732 0.2563 H 1 UNL1111111111 0.1918 31 H -1.8134 2.6232 0.4937 H 1 UNL1111111111 0.1765 32 H -2.0977 2.5889 -1.2587 H 1 UNL1111111111 0.1806 33 H -3.2448 3.4071 -0.1898 H 1 UNL1111111111 0.1675 34 H 4.5179 -2.3107 -0.0866 H 1 UNL1111111111 0.3407 35 H -1.7394 -2.2888 -0.3929 H 1 UNL1111111111 0.3423 36 H -7.1195 -0.7905 0.6108 H 1 UNL1111111111 0.3353 37 H 6.7134 0.0093 0.9805 H 1 UNL1111111111 0.3500 @BOND 1 1 12 1 2 1 18 1 3 2 14 1 4 2 34 1 5 3 15 1 6 3 35 1 7 4 20 1 8 4 36 1 9 5 18 2 10 6 23 1 11 6 37 1 12 7 23 2 13 8 10 ar 14 8 15 ar 15 8 18 1 16 9 11 ar 17 9 13 ar 18 9 19 1 19 10 17 ar 20 10 22 1 21 11 14 ar 22 11 23 1 23 12 13 ar 24 12 16 ar 25 13 24 1 26 14 16 ar 27 15 21 ar 28 16 25 1 29 17 20 ar 30 17 26 1 31 19 27 1 32 19 28 1 33 19 29 1 34 20 21 ar 35 21 30 1 36 22 31 1 37 22 32 1 38 22 33 1