@MOLECULE 5-methoxyresorcinol 18 18 0 0 0 SMALL USER_CHARGES @ATOM 1 O -2.2134 0.8790 -0.0003 O.3 1 UNL1111111 -0.3009 2 O 1.1180 -2.6263 -0.0001 O.3 1 UNL1111111 -0.4669 3 O 2.2747 1.9494 0.0000 O.3 1 UNL1111111 -0.4592 4 C -0.9593 0.3716 -0.0001 C.ar 1 UNL1111111 0.3730 5 C 0.0273 1.3665 -0.0001 C.ar 1 UNL1111111 -0.4221 6 C -0.6450 -0.9915 -0.0000 C.ar 1 UNL1111111 -0.5208 7 C 0.7111 -1.3349 0.0001 C.ar 1 UNL1111111 0.4193 8 C 1.3594 0.9537 0.0000 C.ar 1 UNL1111111 0.4069 9 C 1.7397 -0.3922 0.0002 C.ar 1 UNL1111111 -0.4752 10 C -3.2966 -0.0425 0.0003 C.3 1 UNL1111111 -0.2029 11 H -0.2344 2.4192 -0.0002 H 1 UNL1111111 0.1994 12 H -1.4081 -1.7530 -0.0001 H 1 UNL1111111 0.1737 13 H 2.7742 -0.7064 0.0003 H 1 UNL1111111 0.1883 14 H -3.2869 -0.6563 0.9061 H 1 UNL1111111 0.1362 15 H -3.2870 -0.6580 -0.9043 H 1 UNL1111111 0.1362 16 H -4.1673 0.6282 -0.0003 H 1 UNL1111111 0.1544 17 H 0.3609 -3.2617 -0.0002 H 1 UNL1111111 0.3296 18 H 3.2031 1.6059 0.0002 H 1 UNL1111111 0.3311 @BOND 1 15 10 1 2 1 4 1 3 1 10 1 4 16 10 1 5 17 2 1 6 11 5 1 7 5 4 ar 8 5 8 ar 9 4 6 ar 10 2 7 1 11 12 6 1 12 8 3 1 13 8 9 ar 14 6 7 ar 15 3 18 1 16 7 9 ar 17 9 13 1 18 10 14 1