@MOLECULE N,5-dimethyl-N-propyl-hexanamide 36 35 0 0 0 SMALL USER_CHARGES @ATOM 1 C 4.0882 0.3671 -0.3936 C.3 1 UNL11111111 -0.0547 2 C 4.4321 1.0945 0.9113 C.3 1 UNL11111111 -0.4545 3 C 5.3012 -0.4430 -0.8712 C.3 1 UNL11111111 -0.4611 4 C 2.8800 -0.5715 -0.2055 C.3 1 UNL11111111 -0.2900 5 C 1.5750 0.2167 -0.0580 C.3 1 UNL11111111 -0.2488 6 C 0.3835 -0.7362 0.0928 C.3 1 UNL11111111 -0.3592 7 C -0.8851 0.0607 0.2977 C.2 1 UNL11111111 0.5789 8 O -0.9044 1.2756 0.3076 O.2 1 UNL11111111 -0.5378 9 N -2.0559 -0.6416 0.5667 N.am 1 UNL11111111 -0.5001 10 C -2.1603 -2.0716 0.2749 C.3 1 UNL11111111 -0.2327 11 C -3.3199 0.1070 0.5997 C.3 1 UNL11111111 -0.0653 12 C -3.9319 0.2920 -0.8026 C.3 1 UNL11111111 -0.2890 13 C -5.2720 1.0144 -0.7006 C.3 1 UNL11111111 -0.4364 14 H 3.8356 1.1259 -1.1732 H 1 UNL11111111 0.1321 15 H 5.2936 1.7575 0.7806 H 1 UNL11111111 0.1405 16 H 3.5949 1.7105 1.2589 H 1 UNL11111111 0.1490 17 H 4.6768 0.3892 1.7119 H 1 UNL11111111 0.1420 18 H 5.5704 -1.2225 -0.1510 H 1 UNL11111111 0.1428 19 H 5.1045 -0.9310 -1.8311 H 1 UNL11111111 0.1398 20 H 6.1788 0.1988 -1.0033 H 1 UNL11111111 0.1436 21 H 2.8068 -1.2567 -1.0708 H 1 UNL11111111 0.1336 22 H 3.0403 -1.2162 0.6777 H 1 UNL11111111 0.1367 23 H 1.6241 0.8965 0.8166 H 1 UNL11111111 0.1575 24 H 1.4181 0.8843 -0.9282 H 1 UNL11111111 0.1531 25 H 0.2923 -1.3779 -0.8053 H 1 UNL11111111 0.1593 26 H 0.5490 -1.4171 0.9521 H 1 UNL11111111 0.1646 27 H -1.3851 -2.6315 0.8276 H 1 UNL11111111 0.1461 28 H -3.1378 -2.4633 0.6065 H 1 UNL11111111 0.1508 29 H -2.0575 -2.2889 -0.8018 H 1 UNL11111111 0.1324 30 H -4.0292 -0.4207 1.2728 H 1 UNL11111111 0.1338 31 H -3.1243 1.1074 1.0599 H 1 UNL11111111 0.1693 32 H -3.2308 0.8721 -1.4357 H 1 UNL11111111 0.1542 33 H -4.0576 -0.6849 -1.3016 H 1 UNL11111111 0.1335 34 H -5.7150 1.1674 -1.6918 H 1 UNL11111111 0.1452 35 H -5.9939 0.4485 -0.1018 H 1 UNL11111111 0.1404 36 H -5.1596 2.0033 -0.2388 H 1 UNL11111111 0.1503 @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 2 8 7 9 am 9 9 10 1 10 9 11 1 11 11 12 1 12 12 13 1 13 1 14 1 14 2 15 1 15 2 16 1 16 2 17 1 17 3 18 1 18 3 19 1 19 3 20 1 20 4 21 1 21 4 22 1 22 5 23 1 23 5 24 1 24 6 25 1 25 6 26 1 26 10 27 1 27 10 28 1 28 10 29 1 29 11 30 1 30 11 31 1 31 12 32 1 32 12 33 1 33 13 34 1 34 13 35 1 35 13 36 1