@MOLECULE 1h-1,2,4-triazole-5-diazonium 7 7 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 N 0.6315 -1.1149 0.0001 N.2 1 UNL1 -0.0671 2 N 0.5202 1.2292 0.0000 N.2 1 UNL1 -0.3521 3 N 1.8299 -0.6778 -0.0001 N.2 1 UNL1 -0.1651 4 N -1.5643 -0.0232 0.0001 N.pl3 1 UNL1 0.3797 5 N -2.6864 -0.0666 -0.0002 N.3 1 UNL1 0.0364 6 C -0.2515 0.0245 0.0001 C.1 1 UNL1 -0.1308 7 C 1.7314 0.7374 -0.0001 C.2 1 UNL1 0.2991 @BOND 1 5 4 1 2 7 3 2 3 7 2 1 4 3 1 1 5 2 6 2 6 1 6 2 7 6 4 1