@MOLECULE 3-(2-chloroethyl)-n,n-dimethyl-4-oxo-3,4-dihydroimidazo(5,1-d)-1,2,3,5-tetrazine-8-carboxamide 18 19 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 CL -5.9516 -0.0741 0.0278 Cl 1 UNL1 0.1541 2 O -1.5889 2.0399 -0.0059 O.2 1 UNL1 -0.3669 3 O 3.8988 -2.3637 0.0254 O.2 1 UNL1 -0.1231 4 N 0.3351 0.7550 -0.0130 N.ar 1 UNL1 -0.5584 5 N -1.8056 -0.2665 -0.0271 N.ar 1 UNL1 -0.3052 6 N 4.9269 0.8222 0.0115 N.1 1 UNL1 -0.7258 7 N 2.5759 0.9447 -0.0001 N.pl3 1 UNL1 -0.5140 8 N 0.0177 -1.6529 -0.0272 N.ar 1 UNL1 -0.1662 9 N -1.2489 -1.5269 -0.0327 N.ar 1 UNL1 0.0732 10 C 0.8461 -0.5928 -0.0148 C.ar 1 UNL1 0.1782 11 C 2.2735 -0.4815 -0.0018 C.2 1 UNL1 -0.2156 12 C -1.0627 0.9656 -0.0140 C.ar 1 UNL1 0.6904 13 C -3.1551 -0.2069 -0.0119 C.1 1 UNL1 0.0781 14 C 1.3721 1.7119 -0.0053 C.3 1 UNL1 0.5468 15 C 3.1575 -1.4813 0.0132 C.1 1 UNL1 0.4460 16 C -4.3672 -0.1563 0.0061 C.1 1 UNL1 -0.1374 17 C 6.0416 0.3735 0.0194 C.1 1 UNL1 0.4239 18 C 3.7859 1.5960 0.0046 C.3 1 UNL1 0.5219 @BOND 1 9 8 ar 2 9 5 ar 3 8 10 ar 4 5 12 ar 5 5 13 1 6 10 4 ar 7 10 11 1 8 12 4 ar 9 12 2 2 10 4 14 1 11 13 16 3 12 14 7 1 13 11 7 1 14 11 15 2 15 7 18 1 16 18 6 1 17 16 1 1 18 6 17 3 19 15 3 2