@MOLECULE 4-nitrophenyl beta-d-ribofuranoside 32 33 0 0 0 SMALL USER_CHARGES @ATOM 1 O 1.7567 -0.4196 -0.9214 O.3 1 UNL111 -0.4250 2 O 0.7346 1.0613 0.5316 O.3 1 UNL111 -0.4074 3 O 4.8553 -0.3687 -0.1862 O.3 1 UNL111 -0.5335 4 O 3.8820 1.9787 -0.5560 O.3 1 UNL111 -0.5136 5 O 0.9682 -2.8619 0.2454 O.3 1 UNL111 -0.5176 6 O -5.0472 -0.4742 -1.2575 O.2 1 UNL111 -0.4077 7 O -5.3741 0.0848 0.7942 O.2 1 UNL111 -0.4098 8 N -4.6467 -0.0826 -0.1724 N.pl3 1 UNL111 0.6412 9 C 3.6492 -0.2081 0.5220 C.3 1 UNL111 0.0435 10 C 3.0507 1.2036 0.2511 C.3 1 UNL111 0.0430 11 C 2.6585 -1.1945 -0.1260 C.3 1 UNL111 0.0421 12 C 1.7210 0.9063 -0.4874 C.3 1 UNL111 0.2587 13 C 1.8366 -1.9728 0.9074 C.3 1 UNL111 -0.0503 14 C -0.5500 0.7450 0.2574 C.ar 1 UNL111 0.3321 15 C -1.0171 0.2547 -0.9662 C.ar 1 UNL111 -0.3187 16 C -1.4107 0.9619 1.3500 C.ar 1 UNL111 -0.2759 17 C -2.3724 -0.0161 -1.1041 C.ar 1 UNL111 -0.0079 18 C -2.7582 0.6863 1.2037 C.ar 1 UNL111 -0.0181 19 C -3.2340 0.2004 -0.0237 C.ar 1 UNL111 -0.1605 20 H 3.8292 -0.3979 1.5972 H 1 UNL111 0.1402 21 H 2.9106 1.8193 1.1647 H 1 UNL111 0.1762 22 H 3.1451 -1.8690 -0.8693 H 1 UNL111 0.1870 23 H 1.4816 1.5318 -1.3659 H 1 UNL111 0.1609 24 H 1.2475 -1.3024 1.5603 H 1 UNL111 0.1335 25 H 2.4698 -2.6409 1.5226 H 1 UNL111 0.1547 26 H 5.5452 0.2393 0.1655 H 1 UNL111 0.3302 27 H 4.2132 1.4525 -1.3279 H 1 UNL111 0.3362 28 H 0.3685 -2.3573 -0.3498 H 1 UNL111 0.3219 29 H -0.3420 0.0779 -1.8014 H 1 UNL111 0.1875 30 H -1.0070 1.3440 2.2855 H 1 UNL111 0.1827 31 H -2.7677 -0.3987 -2.0534 H 1 UNL111 0.1878 32 H -3.4548 0.8445 2.0359 H 1 UNL111 0.1868 @BOND 1 31 17 1 2 29 15 1 3 23 12 1 4 27 4 1 5 6 8 2 6 17 15 ar 7 17 19 ar 8 15 14 ar 9 1 12 1 10 1 11 1 11 22 11 1 12 4 10 1 13 12 10 1 14 12 2 1 15 28 5 1 16 3 26 1 17 3 9 1 18 8 19 1 19 8 7 2 20 11 9 1 21 11 13 1 22 19 18 ar 23 5 13 1 24 10 9 1 25 10 21 1 26 14 2 1 27 14 16 ar 28 9 20 1 29 13 25 1 30 13 24 1 31 18 16 ar 32 18 32 1 33 16 30 1