@MOLECULE n~5~-(diaminomethylene)-2-methyl-l-ornithine 29 28 0 0 0 SMALL GASTEIGER @ATOM 1 O 1.5644 -1.9298 0.1916 O.3 1 UNL1111111111 -0.5416 2 O 2.4920 -0.9460 -1.5802 O.2 1 UNL1111111111 -0.5362 3 N 2.9636 1.4319 -0.1625 N.3 1 UNL1111111111 -0.6443 4 N -2.0367 0.0243 -0.2985 N.pl3 1 UNL1111111111 -0.5698 5 N -3.5658 -1.6050 0.3499 N.pl3 1 UNL1111111111 -0.6261 6 N -4.3559 0.6252 0.1602 N.pl3 1 UNL1111111111 -0.6758 7 C 2.1420 0.3825 0.4557 C.3 1 UNL1111111111 0.1871 8 C 0.6916 0.8744 0.6476 C.3 1 UNL1111111111 -0.2869 9 C 0.0025 1.2678 -0.6634 C.3 1 UNL1111111111 -0.2661 10 C 2.7616 -0.0110 1.8026 C.3 1 UNL1111111111 -0.4607 11 C -1.5270 1.3737 -0.4680 C.3 1 UNL1111111111 -0.0744 12 C 2.1007 -0.8647 -0.4445 C.2 1 UNL1111111111 0.5775 13 C -3.2514 -0.2494 0.0502 C.cat 1 UNL1111111111 0.5094 14 H 0.1054 0.0685 1.1430 H 1 UNL1111111111 0.1755 15 H 0.6949 1.7339 1.3454 H 1 UNL1111111111 0.1554 16 H 0.3913 2.2335 -1.0341 H 1 UNL1111111111 0.1383 17 H 0.2071 0.5168 -1.4547 H 1 UNL1111111111 0.1623 18 H 3.7621 -0.4416 1.6882 H 1 UNL1111111111 0.1511 19 H 2.1408 -0.7524 2.3236 H 1 UNL1111111111 0.1686 20 H 2.8572 0.8689 2.4535 H 1 UNL1111111111 0.1668 21 H -1.9794 1.8533 -1.3673 H 1 UNL1111111111 0.1333 22 H -1.7524 2.0286 0.4014 H 1 UNL1111111111 0.1172 23 H 2.6111 1.7176 -1.0643 H 1 UNL1111111111 0.2656 24 H 3.9289 1.1585 -0.2628 H 1 UNL1111111111 0.2600 25 H 1.4701 -2.7280 -0.3860 H 1 UNL1111111111 0.3511 26 H -2.7644 -2.2218 0.2597 H 1 UNL1111111111 0.2985 27 H -4.3709 -1.9729 -0.1309 H 1 UNL1111111111 0.2811 28 H -5.1360 0.3179 0.7140 H 1 UNL1111111111 0.2944 29 H -4.1492 1.5984 0.2846 H 1 UNL1111111111 0.2888 @BOND 1 1 12 1 2 1 25 1 3 2 12 2 4 3 7 1 5 3 23 1 6 3 24 1 7 4 11 1 8 4 13 2 9 5 13 1 10 5 26 1 11 5 27 1 12 6 13 1 13 6 28 1 14 6 29 1 15 7 8 1 16 7 10 1 17 7 12 1 18 8 9 1 19 8 14 1 20 8 15 1 21 9 11 1 22 9 16 1 23 9 17 1 24 10 18 1 25 10 19 1 26 10 20 1 27 11 21 1 28 11 22 1