@MOLECULE (S)-tert-butyl-methyl-propyl-phosphane 28 27 0 0 0 SMALL USER_CHARGES @ATOM 1 C 2.9473 0.3611 0.3593 C.3 1 UNL111111 -0.4406 2 C 1.6570 -0.3985 -0.0388 C.3 1 UNL111111 0.1524 3 C 1.6916 -0.6157 -1.5702 C.3 1 UNL111111 -0.4566 4 C 1.6991 -1.7931 0.6342 C.3 1 UNL111111 -0.4436 5 P 0.0542 0.6190 0.5996 P.3 1 UNL111111 -0.5598 6 C 0.0451 2.1997 -0.4275 C.3 1 UNL111111 -0.4102 7 C -1.4212 -0.4224 -0.0480 C.3 1 UNL111111 -0.2524 8 C -2.8259 0.1667 0.2236 C.3 1 UNL111111 -0.2142 9 C -3.8755 -0.8347 -0.2668 C.3 1 UNL111111 -0.4435 10 H 3.0594 1.3301 -0.1433 H 1 UNL111111 0.1500 11 H 3.0367 0.5355 1.4424 H 1 UNL111111 0.1656 12 H 3.8264 -0.2360 0.0756 H 1 UNL111111 0.1531 13 H 2.6022 -1.1723 -1.8401 H 1 UNL111111 0.1572 14 H 0.8513 -1.2106 -1.9478 H 1 UNL111111 0.1491 15 H 1.7282 0.3187 -2.1435 H 1 UNL111111 0.1508 16 H 1.7097 -1.7494 1.7339 H 1 UNL111111 0.1661 17 H 0.8741 -2.4519 0.3354 H 1 UNL111111 0.1489 18 H 2.6254 -2.3106 0.3433 H 1 UNL111111 0.1551 19 H 0.0449 2.0322 -1.5247 H 1 UNL111111 0.1794 20 H -0.8543 2.8179 -0.1887 H 1 UNL111111 0.1995 21 H 0.9345 2.8312 -0.1873 H 1 UNL111111 0.1994 22 H -1.3230 -0.6141 -1.1474 H 1 UNL111111 0.1685 23 H -1.3624 -1.4340 0.4462 H 1 UNL111111 0.1870 24 H -2.9936 0.3680 1.3035 H 1 UNL111111 0.1558 25 H -2.9770 1.1359 -0.2933 H 1 UNL111111 0.1407 26 H -4.8896 -0.4497 -0.1044 H 1 UNL111111 0.1501 27 H -3.7727 -1.0396 -1.3380 H 1 UNL111111 0.1443 28 H -3.8022 -1.7901 0.2655 H 1 UNL111111 0.1479 @BOND 1 15 3 1 2 14 3 1 3 13 3 1 4 3 2 1 5 19 6 1 6 27 9 1 7 22 7 1 8 6 20 1 9 6 21 1 10 6 5 1 11 25 8 1 12 9 26 1 13 9 8 1 14 9 28 1 15 10 1 1 16 7 8 1 17 7 23 1 18 7 5 1 19 2 1 1 20 2 5 1 21 2 4 1 22 12 1 1 23 8 24 1 24 17 4 1 25 18 4 1 26 1 11 1 27 4 16 1