@MOLECULE 2-hydroxy-1-methyl-1-[6-(methylamino)hexyl]-3-oxotriazane 34 33 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 O 3.3578 -0.4007 1.4134 O.3 1 UNL1 -0.4353 2 O 4.2711 -2.1934 -0.2016 O.2 1 UNL1 -0.1822 3 N 2.6417 0.7384 -0.4685 N.3 1 UNL1 -0.1962 4 N -4.8422 -1.0215 0.2302 N.3 1 UNL1 -0.5243 5 N 2.8775 -0.5253 0.0787 N.4 1 UNL1 -0.0572 6 N 3.5719 -1.3847 -0.7147 N.2 1 UNL1 0.1986 7 C -1.0852 1.2303 0.2398 C.3 1 UNL1 -0.2754 8 C -2.3335 0.5486 -0.3321 C.3 1 UNL1 -0.2609 9 C 0.1791 0.6176 -0.3692 C.3 1 UNL1 -0.2742 10 C -3.6113 1.1269 0.2869 C.3 1 UNL1 -0.2873 11 C 1.4283 1.3345 0.1702 C.3 1 UNL1 -0.1248 12 C -4.8589 0.3879 -0.2301 C.3 1 UNL1 -0.1170 13 C 3.8096 1.6514 -0.3542 C.3 1 UNL1 -0.3108 14 C -6.1082 -1.7087 -0.0931 C.3 1 UNL1 -0.2759 15 H -1.1228 2.3166 0.0376 H 1 UNL1 0.1320 16 H -1.0680 1.1230 1.3408 H 1 UNL1 0.1361 17 H -2.3618 0.6577 -1.4320 H 1 UNL1 0.1376 18 H -2.2947 -0.5454 -0.1486 H 1 UNL1 0.1613 19 H 0.1564 0.6827 -1.4743 H 1 UNL1 0.1543 20 H 0.2311 -0.4658 -0.1437 H 1 UNL1 0.1580 21 H -3.6981 2.2026 0.0449 H 1 UNL1 0.1362 22 H -3.5610 1.0667 1.3896 H 1 UNL1 0.1361 23 H 1.3958 2.4099 -0.1094 H 1 UNL1 0.1431 24 H 1.4617 1.2858 1.2790 H 1 UNL1 0.1406 25 H -4.8600 0.3759 -1.3430 H 1 UNL1 0.1431 26 H -5.7745 0.9317 0.0867 H 1 UNL1 0.1079 27 H -4.6529 -1.0709 1.2297 H 1 UNL1 0.2493 28 H 4.0568 1.9452 0.6772 H 1 UNL1 0.1484 29 H 3.5919 2.5552 -0.9473 H 1 UNL1 0.1585 30 H 4.6997 1.1736 -0.7979 H 1 UNL1 0.1622 31 H -6.0329 -2.7585 0.2373 H 1 UNL1 0.1457 32 H -6.2466 -1.7217 -1.1874 H 1 UNL1 0.1467 33 H -7.0025 -1.2606 0.3645 H 1 UNL1 0.1143 34 H 2.8502 -1.0798 1.9327 H 1 UNL1 0.3112 @BOND 1 19 9 1 2 17 8 1 3 25 12 1 4 32 14 1 5 29 13 1 6 30 13 1 7 6 2 2 8 6 5 1 9 3 13 1 10 3 5 1 11 3 11 1 12 9 20 1 13 9 11 1 14 9 7 1 15 13 28 1 16 8 18 1 17 8 7 1 18 8 10 1 19 12 26 1 20 12 4 1 21 12 10 1 22 23 11 1 23 14 4 1 24 14 31 1 25 14 33 1 26 15 7 1 27 21 10 1 28 5 1 1 29 11 24 1 30 4 27 1 31 7 16 1 32 10 22 1 33 1 34 1