@MOLECULE 3-(2-chloroethyl)-n-methyl-4-oxo-3,4-dihydroimidazo[5,1-d][1,2,3,5]tetrazine-8-carboxamide 26 27 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 CL 5.4465 -0.6063 0.4840 Cl 1 UNL1 -0.1276 2 O 1.7589 2.1192 -0.2484 O.2 1 UNL1 -0.4228 3 O -3.5170 -1.8157 -0.0451 O.2 1 UNL1 -0.4903 4 N -0.3138 1.1112 -0.1429 N.ar 1 UNL1 -0.4238 5 N 1.6108 -0.1710 -0.5569 N.ar 1 UNL1 -0.4254 6 N -2.4532 1.6454 0.2168 N.ar 1 UNL1 -0.3636 7 N -0.3753 -1.2888 -0.4386 N.ar 1 UNL1 -0.1043 8 N 0.8512 -1.3116 -0.5944 N.ar 1 UNL1 0.1265 9 N -4.7812 0.0348 0.3172 N.am 1 UNL1 -0.5465 10 C -1.0719 -0.1069 -0.1951 C.ar 1 UNL1 0.1234 11 C 1.0955 1.1190 -0.3100 C.ar 1 UNL1 0.6665 12 C 3.0702 -0.3475 -0.6836 C.3 1 UNL1 -0.0532 13 C -2.3929 0.2613 0.0323 C.ar 1 UNL1 -0.0049 14 C -1.2245 2.1496 0.1146 C.ar 1 UNL1 0.1850 15 C 3.7059 -0.3694 0.7071 C.3 1 UNL1 -0.2191 16 C -3.5929 -0.6120 0.0954 C.2 1 UNL1 0.5879 17 C -6.0203 -0.7303 0.4268 C.3 1 UNL1 -0.2227 18 H 3.2723 -1.2990 -1.2393 H 1 UNL1 0.1866 19 H 3.4790 0.4890 -1.3056 H 1 UNL1 0.1795 20 H -0.9306 3.1884 0.2084 H 1 UNL1 0.2195 21 H 3.5722 0.5820 1.2514 H 1 UNL1 0.1721 22 H 3.3373 -1.2011 1.3317 H 1 UNL1 0.1719 23 H -4.8227 1.0338 0.4505 H 1 UNL1 0.3297 24 H -6.8075 -0.2776 -0.1997 H 1 UNL1 0.1391 25 H -6.3681 -0.7637 1.4745 H 1 UNL1 0.1392 26 H -5.8727 -1.7768 0.0889 H 1 UNL1 0.1774 @BOND 1 19 12 1 2 18 12 1 3 12 5 1 4 12 15 1 5 8 5 ar 6 8 7 ar 7 5 11 ar 8 7 10 ar 9 11 2 2 10 11 4 ar 11 24 17 1 12 10 4 ar 13 10 13 ar 14 4 14 ar 15 3 16 2 16 13 16 1 17 13 6 ar 18 26 17 1 19 16 9 am 20 14 20 1 21 14 6 ar 22 9 17 1 23 9 23 1 24 17 25 1 25 1 15 1 26 15 21 1 27 15 22 1