@MOLECULE 8-acetamido-6,7-dihydroxy-5-(hydroxymethyl)-2-(phenylcarbamoyl)-5,6,7,8-tetrahydro-1h-imidazo[1,2-a]pyridin-4-ium 26 25 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 O 3.7770 0.6088 0.0294 O.2 1 UNL1 -0.5691 2 C 4.8362 0.3781 -1.9631 C.3 2 UNL2 0.1240 3 C 3.8461 1.6762 -0.4144 C.2 1 UNL1 0.5923 4 N 3.3684 -2.0710 1.3424 N.2 1 UNL1 -0.3840 5 C 2.1214 -1.8075 1.0348 C.1 1 UNL1 0.1424 6 C 5.0805 -0.9209 -2.0279 C.3 2 UNL2 -0.0042 7 O 5.3084 -2.0691 -2.1050 O.3 2 UNL2 -0.1400 8 C 4.3926 -1.3650 1.4677 C.1 1 UNL1 0.6008 9 O 5.4887 -1.0260 1.6648 O.2 1 UNL1 -0.2460 10 C 0.3141 2.9586 0.1434 C.1 1 UNL1 -0.6625 11 C 0.7478 4.1588 0.1157 C.1 1 UNL1 0.6262 12 O 1.1586 5.2442 0.0897 O.3 1 UNL1 -0.2751 13 C 0.9307 -1.6672 0.7694 C.1 1 UNL1 -0.0327 14 N -0.1536 1.8078 0.1801 N.pl3 1 UNL1 0.4168 15 C -0.5794 0.7285 0.2142 C.3 1 UNL1 -0.2235 16 C -1.0637 -0.5985 0.2718 C.2 1 UNL1 0.2248 17 N -0.3658 -1.6640 0.5226 N.2 1 UNL1 -0.1388 18 C -2.5017 -0.7413 0.0403 C.ar 1 UNL1 0.2708 19 O -3.2247 0.4344 0.3704 O.2 1 UNL1 -0.1804 20 N -3.2440 -1.7218 -0.4153 N.ar 1 UNL1 -0.2710 21 C -4.5574 -1.2827 -0.4211 C.ar 1 UNL1 0.0640 22 C -5.8190 -1.6930 -0.7281 C.ar 1 UNL1 -0.0051 23 C -6.8899 -1.0025 -0.6105 C.ar 1 UNL1 -0.0183 24 C -6.8281 0.2500 -0.1480 C.ar 1 UNL1 0.0863 25 C -5.7120 0.7835 0.1851 C.ar 1 UNL1 -0.1325 26 C -4.5193 0.1479 0.1046 C.ar 1 UNL1 0.1349 @BOND 1 7 6 1 2 6 2 1 3 22 23 ar 4 22 21 ar 5 23 24 ar 6 21 20 ar 7 21 26 ar 8 20 18 ar 9 3 1 2 10 24 25 ar 11 18 16 1 12 18 19 ar 13 12 11 1 14 26 25 ar 15 26 19 ar 16 11 10 3 17 10 14 1 18 14 15 1 19 15 16 1 20 16 17 2 21 17 13 1 22 13 5 3 23 5 4 1 24 4 8 2 25 8 9 2