@MOLECULE 1,3-benzothiazole-2,6-diamine 18 19 0 0 0 SMALL GASTEIGER @ATOM 1 N 3.7764 0.6669 -0.0368 N.pl3 1 UNL1111111111 -0.6239 2 C 2.4760 0.1698 0.0186 C.ar 1 UNL1111111111 0.2486 3 C 1.3887 1.0635 0.0133 C.ar 1 UNL1111111111 -0.2683 4 C 0.1144 0.5284 -0.0014 C.ar 1 UNL1111111111 -0.1064 5 S -1.4343 1.3701 -0.0068 S.2 1 UNL1111111111 0.0738 6 C -2.2655 -0.2595 -0.0249 C.ar 1 UNL1111111111 0.2850 7 N -3.6302 -0.3690 0.0722 N.pl3 1 UNL1111111111 -0.5846 8 N -1.4446 -1.2849 -0.0350 N.ar 1 UNL1111111111 -0.4601 9 C -0.1025 -0.8714 -0.0088 C.ar 1 UNL1111111111 0.0674 10 C 0.9847 -1.7518 -0.0014 C.ar 1 UNL1111111111 -0.0695 11 C 2.2667 -1.2302 0.0136 C.ar 1 UNL1111111111 -0.2669 12 H 3.9313 1.6300 0.1735 H 1 UNL1111111111 0.2918 13 H 1.5574 2.1358 0.0131 H 1 UNL1111111111 0.1694 14 H -4.2113 0.3578 -0.2969 H 1 UNL1111111111 0.3032 15 H -4.0213 -1.2973 0.0201 H 1 UNL1111111111 0.3097 16 H 0.8054 -2.8276 -0.0065 H 1 UNL1111111111 0.1741 17 H 3.1230 -1.8998 0.0127 H 1 UNL1111111111 0.1640 18 H 4.5331 0.0563 0.1883 H 1 UNL1111111111 0.2925 @BOND 1 1 2 1 2 1 12 1 3 1 18 1 4 2 3 ar 5 2 11 ar 6 3 4 ar 7 3 13 1 8 4 5 ar 9 4 9 ar 10 5 6 ar 11 6 7 1 12 6 8 ar 13 7 14 1 14 7 15 1 15 8 9 ar 16 9 10 ar 17 10 11 ar 18 10 16 1 19 11 17 1