@MOLECULE dimethyl-[(1S)-1-methylpropyl]imino-ammonium 23 22 0 0 0 SMALL USER_CHARGES @ATOM 1 C -2.4437 1.3799 -0.5153 C.3 1 UNL111 -0.4380 2 C -2.1548 0.1288 0.3114 C.3 1 UNL111 -0.2544 3 C -0.8194 -0.5302 -0.1172 C.3 1 UNL111 0.0399 4 H -0.7717 -0.5526 -1.2355 H 1 UNL111 0.1248 5 C -0.7480 -1.9709 0.4263 C.3 1 UNL111 -0.4705 6 N 0.2456 0.2757 0.4817 N.2 1 UNL111 -0.3657 7 N 1.3976 0.3993 -0.1412 N.2 1 UNL111 -0.1314 8 C 1.9021 -0.5788 -1.1268 C.3 1 UNL111 -0.3212 9 C 2.4566 0.9375 0.7423 C.3 1 UNL111 -0.2549 10 H -1.6262 2.1073 -0.4139 H 1 UNL111 0.1580 11 H -2.5490 1.1496 -1.5798 H 1 UNL111 0.1359 12 H -3.3645 1.8709 -0.1835 H 1 UNL111 0.1398 13 H -2.1033 0.3913 1.3870 H 1 UNL111 0.1539 14 H -2.9783 -0.5991 0.2061 H 1 UNL111 0.1325 15 H -1.5865 -2.5720 0.0632 H 1 UNL111 0.1474 16 H 0.1789 -2.4678 0.1281 H 1 UNL111 0.1397 17 H -0.7799 -1.9718 1.5231 H 1 UNL111 0.1600 18 H 1.1663 -0.7136 -1.9366 H 1 UNL111 0.1553 19 H 2.8266 -0.1946 -1.5863 H 1 UNL111 0.1541 20 H 2.1162 -1.5616 -0.6796 H 1 UNL111 0.1415 21 H 2.0070 1.5597 1.5397 H 1 UNL111 0.1727 22 H 3.0456 0.1436 1.2245 H 1 UNL111 0.1346 23 H 3.1192 1.5807 0.1409 H 1 UNL111 0.1459 @BOND 1 1 2 1 2 2 3 1 3 3 4 1 4 3 5 1 5 3 6 1 6 6 7 2 7 7 8 1 8 7 9 1 9 1 10 1 10 1 11 1 11 1 12 1 12 2 13 1 13 2 14 1 14 5 15 1 15 5 16 1 16 5 17 1 17 8 18 1 18 8 19 1 19 8 20 1 20 9 21 1 21 9 22 1 22 9 23 1