@MOLECULE (6r,7r)-6-(3h-diimidazo[1,2-c:4',5'-e][1,2,3]triazin-3-yl)tetrahydro-4h-furo[3,2-d][1,3,2]dioxaphosphinine-2,7-diol 2-oxide 24 27 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 O 1.0136 2.4248 -0.2631 O.2 1 UNL1 -0.1386 2 C 1.2364 1.0702 0.0821 C.2 1 UNL1 -0.0217 3 C 2.2259 0.2470 0.3946 C.2 1 UNL1 0.1308 4 O 3.4937 0.6825 0.5714 O.2 1 UNL1 -0.2975 5 P 4.7721 0.1225 -0.2911 P.3 1 UNL1 0.3800 6 O 5.8887 0.3975 0.5728 O.3 1 UNL1 -0.1380 7 O 4.5051 0.0021 -1.7015 O.2 1 UNL1 -0.2188 8 O 4.3595 -1.6338 0.1879 O.3 1 UNL1 -0.1395 9 C 3.2762 -1.9778 0.5181 C.3 1 UNL1 0.3017 10 C 1.9801 -1.1999 0.7081 C.2 1 UNL1 0.3129 11 O 0.9585 -1.6954 1.0656 O.2 1 UNL1 -0.2463 12 C -0.0613 1.5557 -0.1764 C.2 1 UNL1 0.3632 13 N -1.3116 1.7062 -0.3339 N.2 1 UNL1 -0.3270 14 C -4.4936 3.2098 0.6099 C.1 1 UNL1 0.4547 15 N -4.0663 2.1257 0.3540 N.1 1 UNL1 -0.5431 16 C -3.5867 0.8977 0.0409 C.3 1 UNL1 0.2304 17 C -2.2077 0.6594 -0.2700 C.2 1 UNL1 0.1547 18 N -1.7724 -0.6393 -0.5828 N.2 1 UNL1 -0.1991 19 N -2.4958 -1.6521 -0.6286 N.pl3 1 UNL1 0.1626 20 N -3.8293 -1.5430 -0.3432 N.ar 1 UNL1 -0.4286 21 C -4.4088 -0.2357 0.0134 C.ar 1 UNL1 0.1002 22 N -5.7693 -0.4375 0.2653 N.ar 1 UNL1 -0.3370 23 C -5.9737 -1.6977 0.0727 C.ar 1 UNL1 0.0539 24 C -4.7839 -2.5683 -0.3396 C.ar 1 UNL1 0.3901 @BOND 1 7 5 2 2 19 18 1 3 19 20 1 4 18 17 2 5 20 24 ar 6 20 21 ar 7 24 23 ar 8 13 17 1 9 13 12 2 10 5 8 1 11 5 4 1 12 5 6 1 13 17 16 1 14 1 12 1 15 1 2 1 16 12 2 1 17 21 16 1 18 21 22 ar 19 16 15 1 20 23 22 ar 21 2 3 2 22 8 9 1 23 15 14 3 24 3 4 1 25 3 10 1 26 9 10 1 27 10 11 2