@MOLECULE N-ethyl-N,4-dimethyl-pentan-1-amine 31 30 0 0 0 SMALL USER_CHARGES @ATOM 1 C -2.9847 -0.0751 -0.4139 C.3 1 UNL11111111 -0.0542 2 C -4.1896 -0.9590 -0.0651 C.3 1 UNL11111111 -0.4579 3 C -3.2949 1.3864 -0.0681 C.3 1 UNL11111111 -0.4536 4 C -1.7389 -0.5709 0.3464 C.3 1 UNL11111111 -0.2923 5 C -0.4551 0.0176 -0.2454 C.3 1 UNL11111111 -0.2776 6 C 0.7692 -0.4162 0.5845 C.3 1 UNL11111111 -0.1200 7 N 1.9945 0.1020 -0.0783 N.3 1 UNL11111111 -0.4135 8 C 2.2234 1.5198 0.2726 C.3 1 UNL11111111 -0.2767 9 C 3.1742 -0.7318 0.2696 C.3 1 UNL11111111 -0.0948 10 C 4.3505 -0.3893 -0.6541 C.3 1 UNL11111111 -0.4469 11 H -2.7904 -0.1524 -1.5110 H 1 UNL11111111 0.1309 12 H -5.0874 -0.6341 -0.6011 H 1 UNL11111111 0.1414 13 H -4.0083 -2.0051 -0.3323 H 1 UNL11111111 0.1412 14 H -4.4157 -0.9238 1.0055 H 1 UNL11111111 0.1435 15 H -3.4939 1.5119 1.0011 H 1 UNL11111111 0.1431 16 H -2.4586 2.0445 -0.3271 H 1 UNL11111111 0.1431 17 H -4.1753 1.7439 -0.6120 H 1 UNL11111111 0.1402 18 H -1.8250 -0.3104 1.4169 H 1 UNL11111111 0.1372 19 H -1.6937 -1.6757 0.3067 H 1 UNL11111111 0.1370 20 H -0.3199 -0.3103 -1.2944 H 1 UNL11111111 0.1535 21 H -0.5162 1.1198 -0.2881 H 1 UNL11111111 0.1401 22 H 0.6675 -0.0712 1.6338 H 1 UNL11111111 0.1136 23 H 0.8089 -1.5265 0.6154 H 1 UNL11111111 0.1326 24 H 2.5104 1.6875 1.3208 H 1 UNL11111111 0.1156 25 H 3.0189 1.9208 -0.3775 H 1 UNL11111111 0.1459 26 H 1.3134 2.1046 0.0630 H 1 UNL11111111 0.1430 27 H 3.4773 -0.6261 1.3323 H 1 UNL11111111 0.1083 28 H 2.8959 -1.7990 0.1150 H 1 UNL11111111 0.1337 29 H 4.0081 -0.2984 -1.6943 H 1 UNL11111111 0.1627 30 H 4.8241 0.5580 -0.3809 H 1 UNL11111111 0.1410 31 H 5.1150 -1.1710 -0.6194 H 1 UNL11111111 0.1400 @BOND 1 1 2 1 2 1 3 1 3 1 4 1 4 4 5 1 5 5 6 1 6 6 7 1 7 7 8 1 8 7 9 1 9 9 10 1 10 1 11 1 11 2 12 1 12 2 13 1 13 2 14 1 14 3 15 1 15 3 16 1 16 3 17 1 17 4 18 1 18 4 19 1 19 5 20 1 20 5 21 1 21 6 22 1 22 6 23 1 23 8 24 1 24 8 25 1 25 8 26 1 26 9 27 1 27 9 28 1 28 10 29 1 29 10 30 1 30 10 31 1