@MOLECULE 2h-isoindole-1,3-diamine 20 21 0 0 0 SMALL GASTEIGER @ATOM 1 N -1.7671 2.3923 0.0155 N.pl3 1 UNL11111111 -0.6029 2 C -1.1278 1.1322 -0.0052 C.ar 1 UNL11111111 0.1026 3 N -1.9281 0.0012 -0.0005 N.ar 1 UNL11111111 -0.2231 4 C -1.1295 -1.1311 0.0061 C.ar 1 UNL11111111 0.1035 5 N -1.7714 -2.3897 -0.0179 N.pl3 1 UNL11111111 -0.6032 6 C 0.2212 -0.7216 0.0047 C.ar 1 UNL11111111 -0.0999 7 C 1.4454 -1.4284 0.0093 C.ar 1 UNL11111111 -0.1326 8 C 2.6138 -0.7151 0.0047 C.ar 1 UNL11111111 -0.1538 9 C 2.6144 0.7130 -0.0052 C.ar 1 UNL11111111 -0.1535 10 C 1.4462 1.4264 -0.0089 C.ar 1 UNL11111111 -0.1331 11 C 0.2220 0.7200 -0.0036 C.ar 1 UNL11111111 -0.0996 12 H -1.4483 2.9771 0.7765 H 1 UNL11111111 0.2726 13 H -1.6796 2.8893 -0.8611 H 1 UNL11111111 0.2709 14 H -2.9291 0.0020 -0.0016 H 1 UNL11111111 0.3228 15 H -1.4351 -2.9834 -0.7639 H 1 UNL11111111 0.2730 16 H -1.7105 -2.8775 0.8660 H 1 UNL11111111 0.2708 17 H 1.4367 -2.5137 0.0169 H 1 UNL11111111 0.1449 18 H 3.5748 -1.2254 0.0094 H 1 UNL11111111 0.1478 19 H 3.5757 1.2227 -0.0089 H 1 UNL11111111 0.1478 20 H 1.4374 2.5118 -0.0157 H 1 UNL11111111 0.1449 @BOND 1 1 2 1 2 1 12 1 3 1 13 1 4 2 11 ar 5 2 3 ar 6 3 4 ar 7 3 14 1 8 4 5 1 9 5 15 1 10 5 16 1 11 6 4 ar 12 6 7 ar 13 7 17 1 14 8 7 ar 15 8 18 1 16 9 8 ar 17 9 19 1 18 10 11 ar 19 10 9 ar 20 10 20 1 21 11 6 ar