@MOLECULE 3h-1,2,3-triazolo[4,5-d]pyrimidine-5,7-diol 14 15 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 O -0.3966 2.6395 -0.0069 O.2 1 UNL1 -0.3985 2 O -2.9060 -1.1423 0.0054 O.2 1 UNL1 -0.3809 3 N 1.8042 -1.5027 -0.1083 N.pl3 1 UNL1 -0.3620 4 N -1.6235 0.7289 0.0059 N.am 1 UNL1 -0.6788 5 N 2.7230 -0.4030 0.1187 N.3 1 UNL1 -0.1729 6 N 2.0623 0.7801 -0.0062 N.3 1 UNL1 -0.0200 7 N -0.6327 -1.5170 0.0165 N.am 1 UNL1 -0.4950 8 C 0.7680 0.5506 -0.0165 C.3 1 UNL1 -0.1679 9 C 0.5167 -0.9250 -0.0135 C.2 1 UNL1 0.3508 10 C -0.4076 1.4364 -0.0027 C.2 1 UNL1 0.6060 11 C -1.7917 -0.6967 0.0045 C.2 1 UNL1 0.6963 12 H 2.0257 -2.3292 0.4532 H 1 UNL1 0.3377 13 H -2.4849 1.2881 0.0109 H 1 UNL1 0.3511 14 H 3.5649 -0.4850 -0.4744 H 1 UNL1 0.3338 @BOND 1 14 5 1 2 3 9 1 3 3 5 1 4 3 12 1 5 8 9 1 6 8 6 1 7 8 10 1 8 9 7 2 9 1 10 2 10 6 5 1 11 10 4 am 12 11 2 2 13 11 4 am 14 11 7 1 15 4 13 1