@MOLECULE vitamin c 20 20 0 0 0 SMALL USER_CHARGES @ATOM 1 O -0.0917 1.1690 0.5677 O.3 1 UNL11111111 -0.3989 2 O 1.3381 -0.6312 -1.3086 O.3 1 UNL11111111 -0.5445 3 O -0.9488 -2.3543 0.4460 O.2 1 UNL11111111 -0.3909 4 O 3.8834 0.2135 -0.1275 O.3 1 UNL11111111 -0.5315 5 O -3.0718 -0.5448 -0.5470 O.2 1 UNL11111111 -0.3693 6 O -1.9005 2.2573 -0.1943 O.2 1 UNL11111111 -0.4014 7 C 0.2909 -0.1977 0.8296 C.3 1 UNL11111111 -0.0094 8 C 1.5895 -0.4707 0.0642 C.3 1 UNL11111111 0.0705 9 C -0.8928 -1.0200 0.3594 C.2 1 UNL11111111 0.1457 10 C 2.6109 0.6574 0.2815 C.3 1 UNL11111111 -0.0419 11 C -1.8726 -0.1872 -0.0587 C.2 1 UNL11111111 -0.0239 12 C -1.3922 1.2097 0.0694 C.2 1 UNL11111111 0.5444 13 H 0.4336 -0.2615 1.9327 H 1 UNL11111111 0.1770 14 H 2.0270 -1.4605 0.3460 H 1 UNL11111111 0.1648 15 H 2.3404 1.5752 -0.2717 H 1 UNL11111111 0.1403 16 H 2.7512 0.9062 1.3499 H 1 UNL11111111 0.1554 17 H 0.9044 0.1680 -1.6841 H 1 UNL11111111 0.3299 18 H -0.0852 -2.7507 0.1345 H 1 UNL11111111 0.3320 19 H 3.8520 -0.0790 -1.0655 H 1 UNL11111111 0.3237 20 H -3.6392 0.2678 -0.6881 H 1 UNL11111111 0.3280 @BOND 1 17 2 1 2 2 8 1 3 19 4 1 4 20 5 1 5 5 11 1 6 15 10 1 7 6 12 2 8 4 10 1 9 11 12 1 10 11 9 2 11 8 10 1 12 8 14 1 13 8 7 1 14 12 1 1 15 18 3 1 16 10 16 1 17 9 3 1 18 9 7 1 19 1 7 1 20 7 13 1