@MOLECULE N-isopropyl-2-methyl-butan-2-amine 28 27 0 0 0 SMALL USER_CHARGES @ATOM 1 C -1.7907 -0.0548 -0.1660 C.3 1 UNL11111111 0.1167 2 C -2.7445 -1.2159 0.1767 C.3 1 UNL11111111 -0.4579 3 C -2.4537 1.2849 0.2136 C.3 1 UNL11111111 -0.5026 4 N -0.5339 -0.2950 0.5717 N.3 1 UNL11111111 -0.6215 5 C 0.7373 0.0221 -0.1279 C.3 1 UNL11111111 0.2742 6 C 0.8897 -0.9410 -1.3188 C.3 1 UNL11111111 -0.4657 7 C 0.8039 1.4809 -0.6276 C.3 1 UNL11111111 -0.5091 8 C 1.8552 -0.2321 0.9270 C.3 1 UNL11111111 -0.2912 9 C 3.2713 -0.1132 0.3710 C.3 1 UNL11111111 -0.4304 10 H -1.5910 -0.0639 -1.2672 H 1 UNL11111111 0.1285 11 H -3.6841 -1.1337 -0.3737 H 1 UNL11111111 0.1379 12 H -2.2789 -2.1779 -0.0718 H 1 UNL11111111 0.1561 13 H -2.9711 -1.2416 1.2471 H 1 UNL11111111 0.1474 14 H -2.7147 1.3159 1.2761 H 1 UNL11111111 0.1486 15 H -1.7936 2.1322 0.0075 H 1 UNL11111111 0.1467 16 H -3.3772 1.4372 -0.3537 H 1 UNL11111111 0.1507 17 H -0.5689 0.1211 1.4974 H 1 UNL11111111 0.2641 18 H 0.1011 -0.7960 -2.0635 H 1 UNL11111111 0.1432 19 H 1.8497 -0.8021 -1.8228 H 1 UNL11111111 0.1452 20 H 0.8260 -1.9819 -0.9778 H 1 UNL11111111 0.1594 21 H 0.6854 2.1911 0.1950 H 1 UNL11111111 0.1454 22 H 1.7651 1.6880 -1.1080 H 1 UNL11111111 0.1531 23 H 0.0239 1.6854 -1.3670 H 1 UNL11111111 0.1485 24 H 1.7288 0.4734 1.7692 H 1 UNL11111111 0.1326 25 H 1.7077 -1.2458 1.3533 H 1 UNL11111111 0.1534 26 H 4.0134 -0.2170 1.1717 H 1 UNL11111111 0.1406 27 H 3.4814 -0.8936 -0.3692 H 1 UNL11111111 0.1440 28 H 3.4427 0.8561 -0.1094 H 1 UNL11111111 0.1419 @BOND 1 1 2 1 2 1 3 1 3 1 4 1 4 4 5 1 5 5 6 1 6 5 7 1 7 5 8 1 8 8 9 1 9 1 10 1 10 2 11 1 11 2 12 1 12 2 13 1 13 3 14 1 14 3 15 1 15 3 16 1 16 4 17 1 17 6 18 1 18 6 19 1 19 6 20 1 20 7 21 1 21 7 22 1 22 7 23 1 23 8 24 1 24 8 25 1 25 9 26 1 26 9 27 1 27 9 28 1