@MOLECULE 3',5'-bis-o-[(phosphonatooxy)phosphinato]adenosine 35 38 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 N -6.1639 -1.7944 -0.6955 N.2 1 UNL1 -0.2957 2 C -4.9186 -2.0104 -0.4675 C.2 1 UNL1 0.3098 3 N -3.8580 -1.2791 -0.1268 N.2 1 UNL1 -0.3435 4 C -6.5327 -0.4240 -0.5544 C.2 1 UNL1 0.1518 5 C -5.4985 0.5324 -0.1713 C.3 1 UNL1 0.1163 6 C -4.1420 0.0456 0.0305 C.2 1 UNL1 0.2830 7 N -3.1785 0.9574 0.3875 N.pl3 1 UNL1 -0.3974 8 C -6.0249 2.9993 0.1539 C.1 1 UNL1 0.4328 9 N -5.8097 1.8360 -0.0081 N.1 1 UNL1 -0.5271 10 C 0.3527 0.8643 0.9632 C.ar 1 UNL1 0.1770 11 C -0.8667 1.6320 0.9101 C.ar 1 UNL1 -0.0947 12 C -1.9144 0.7135 0.5493 C.ar 1 UNL1 0.3378 13 O -1.3484 -0.5618 0.3998 O.2 1 UNL1 -0.1261 14 C 0.0235 -0.4337 0.6136 C.ar 1 UNL1 -0.0688 15 C 0.8497 -1.6156 0.4068 C.3 1 UNL1 0.6715 16 O 2.1040 -1.4000 0.5621 O.3 1 UNL1 -0.3508 17 O -0.8773 2.9371 1.1301 O.3 1 UNL1 0.1204 18 O 1.5296 1.3583 1.3582 O.3 1 UNL1 -0.1478 19 N -7.7818 -0.1092 -0.7806 N.2 1 UNL1 -0.0909 20 P 0.9422 -4.2032 -0.2611 P.3 1 UNL1 0.3833 21 O 0.3740 -4.5279 -1.5370 O.2 1 UNL1 -0.1602 22 O 0.2343 -2.6976 0.0941 O.3 1 UNL1 -0.3439 23 O 2.5022 -3.7700 -0.1743 O.3 1 UNL1 -0.0861 24 O 1.0733 -4.8998 1.0288 O.3 1 UNL1 -0.1200 25 P 3.4030 -2.4701 0.2907 P.3 1 UNL1 0.3638 26 O 4.0125 -2.5525 1.5911 O.3 1 UNL1 -0.1862 27 O 3.8781 -2.1858 -1.0558 O.2 1 UNL1 -0.1712 28 P 2.8986 2.8011 -1.5739 P.3 1 UNL1 0.4197 29 O 4.3219 3.2660 -1.6809 O.3 1 UNL1 -0.0397 30 O 2.3652 1.4598 -2.0076 O.3 1 UNL1 -0.0525 31 O 2.6596 3.1134 -0.0393 O.3 1 UNL1 -0.2023 32 O 2.2791 3.6850 -2.6027 O.2 1 UNL1 -0.1289 33 P 1.6856 2.9829 1.1787 P.3 1 UNL1 0.4237 34 O 0.3305 3.5378 0.5242 O.3 1 UNL1 -0.1011 35 O 2.2541 3.5712 2.3605 O.2 1 UNL1 -0.1559 @BOND 1 32 28 2 2 30 28 1 3 29 28 1 4 28 31 1 5 21 20 2 6 27 25 2 7 19 4 2 8 1 4 1 9 1 2 2 10 4 5 1 11 2 3 1 12 20 23 1 13 20 22 1 14 20 24 1 15 23 25 1 16 5 9 1 17 5 6 1 18 3 6 2 19 31 33 1 20 9 8 3 21 6 7 1 22 22 15 1 23 25 16 1 24 25 26 1 25 7 12 1 26 13 12 ar 27 13 14 ar 28 15 16 1 29 15 14 1 30 34 17 1 31 34 33 1 32 12 11 ar 33 14 10 ar 34 11 10 ar 35 11 17 1 36 10 18 1 37 33 18 1 38 33 35 2