@MOLECULE di-tert-butylamine 28 27 0 0 0 SMALL USER_CHARGES @ATOM 1 C -1.6254 -1.4109 -0.4684 C.3 1 UNL111111111 -0.4719 2 C -1.3020 0.0017 0.0586 C.3 1 UNL111111111 0.3096 3 C -1.4158 1.0284 -1.0868 C.3 1 UNL111111111 -0.5080 4 C -2.3628 0.3686 1.1325 C.3 1 UNL111111111 -0.4859 5 N 0.0004 -0.0124 0.7625 N.3 1 UNL111111111 -0.6419 6 C 1.3014 0.0013 0.0584 C.3 1 UNL111111111 0.3071 7 C 1.6961 1.4069 -0.4580 C.3 1 UNL111111111 -0.5153 8 C 2.3392 -0.4178 1.1353 C.3 1 UNL111111111 -0.4744 9 C 1.3685 -1.0058 -1.0978 C.3 1 UNL111111111 -0.4725 10 H -1.1458 -1.6153 -1.4285 H 1 UNL111111111 0.1442 11 H -1.2780 -2.1699 0.2443 H 1 UNL111111111 0.1622 12 H -2.7020 -1.5448 -0.6062 H 1 UNL111111111 0.1418 13 H -2.4274 1.0323 -1.5057 H 1 UNL111111111 0.1510 14 H -1.1978 2.0412 -0.7357 H 1 UNL111111111 0.1469 15 H -0.7274 0.7978 -1.9047 H 1 UNL111111111 0.1494 16 H -2.3076 -0.3239 1.9809 H 1 UNL111111111 0.1582 17 H -2.2203 1.3829 1.5140 H 1 UNL111111111 0.1413 18 H -3.3732 0.3091 0.7189 H 1 UNL111111111 0.1499 19 H 0.0124 0.6899 1.5020 H 1 UNL111111111 0.2665 20 H 1.5648 2.1685 0.3150 H 1 UNL111111111 0.1442 21 H 2.7462 1.4257 -0.7652 H 1 UNL111111111 0.1516 22 H 1.0991 1.7041 -1.3233 H 1 UNL111111111 0.1496 23 H 2.0514 -1.3749 1.5871 H 1 UNL111111111 0.1597 24 H 3.3345 -0.5317 0.7005 H 1 UNL111111111 0.1439 25 H 2.4028 0.3175 1.9414 H 1 UNL111111111 0.1418 26 H 0.7114 -0.7260 -1.9263 H 1 UNL111111111 0.1458 27 H 2.3863 -1.0755 -1.4951 H 1 UNL111111111 0.1457 28 H 1.0747 -2.0062 -0.7558 H 1 UNL111111111 0.1593 @BOND 1 1 2 1 2 2 3 1 3 2 4 1 4 2 5 1 5 5 6 1 6 6 7 1 7 6 8 1 8 6 9 1 9 1 10 1 10 1 11 1 11 1 12 1 12 3 13 1 13 3 14 1 14 3 15 1 15 4 16 1 16 4 17 1 17 4 18 1 18 5 19 1 19 7 20 1 20 7 21 1 21 7 22 1 22 8 23 1 23 8 24 1 24 8 25 1 25 9 26 1 26 9 27 1 27 9 28 1