@MOLECULE 1,2,4-triazine 9 9 0 0 0 SMALL USER_CHARGES @ATOM 1 N -1.3535 -0.3280 -0.0000 N.2 1 UNL11111111 -0.3558 2 N 1.3256 0.2969 0.0000 N.2 1 UNL11111111 -0.0769 3 N 0.9564 -0.9405 0.0000 N.2 1 UNL11111111 -0.1927 4 C -0.9720 0.9612 0.0000 C.2 1 UNL11111111 0.0367 5 C 0.3997 1.2878 -0.0000 C.2 1 UNL11111111 -0.1416 6 C -0.3724 -1.2594 -0.0000 C.1 1 UNL11111111 0.1228 7 H -1.7658 1.7174 0.0001 H 1 UNL11111111 0.1947 8 H 0.7732 2.3140 -0.0000 H 1 UNL11111111 0.2012 9 H -0.6534 -2.3225 -0.0000 H 1 UNL11111111 0.2117 @BOND 1 1 4 2 2 1 6 2 3 2 3 1 4 2 5 2 5 3 6 2 6 4 5 1 7 4 7 1 8 5 8 1 9 6 9 1