@MOLECULE (z)-2-hydroxy-2-[(1-methoxy-1-oxo-2-hexanyl)amino]ethenediazonium 30 29 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 O -2.1841 -2.0767 0.2938 O.3 1 UNL1 -0.3955 2 O -1.0441 -1.3588 -1.5133 O.2 1 UNL1 -0.5082 3 O 1.9180 -0.3864 2.1755 O.2 1 UNL1 -0.5122 4 N 0.9475 -0.3966 0.1361 N.am 1 UNL1 -0.6261 5 N 3.5654 0.2007 -0.9036 N.3 1 UNL1 0.3610 6 N 3.7826 0.3028 -2.0115 N.3 1 UNL1 -0.1380 7 C -1.1003 0.6429 1.1306 C.3 1 UNL1 -0.3030 8 C -1.3038 1.6072 -0.0412 C.3 1 UNL1 -0.2731 9 C -0.3667 -0.6522 0.7266 C.3 1 UNL1 0.0291 10 C -2.1045 2.8371 0.4064 C.3 1 UNL1 -0.2457 11 C -1.1988 -1.3848 -0.3201 C.2 1 UNL1 0.5690 12 C -2.3269 3.7918 -0.7663 C.3 1 UNL1 -0.4390 13 C 2.0409 -0.2383 0.9767 C.2 1 UNL1 0.6504 14 C -3.0875 -2.7722 -0.5624 C.3 1 UNL1 -0.1688 15 C 3.3318 0.0900 0.3605 C.3 1 UNL1 -0.5107 16 H -2.0748 0.3796 1.5878 H 1 UNL1 0.1570 17 H -0.5151 1.1405 1.9337 H 1 UNL1 0.1705 18 H -0.2373 -1.3022 1.6444 H 1 UNL1 0.1998 19 H -1.8251 1.1024 -0.8776 H 1 UNL1 0.1459 20 H -0.3263 1.9279 -0.4482 H 1 UNL1 0.1399 21 H -1.5705 3.3588 1.2234 H 1 UNL1 0.1366 22 H -3.0783 2.5253 0.8290 H 1 UNL1 0.1343 23 H 0.9661 -0.2109 -0.8537 H 1 UNL1 0.3237 24 H -2.8707 3.3039 -1.5834 H 1 UNL1 0.1445 25 H -1.3771 4.1546 -1.1750 H 1 UNL1 0.1433 26 H -2.9092 4.6681 -0.4610 H 1 UNL1 0.1409 27 H -3.7892 -3.2302 0.1443 H 1 UNL1 0.1489 28 H -2.5500 -3.5309 -1.1413 H 1 UNL1 0.1432 29 H -3.5936 -2.0676 -1.2306 H 1 UNL1 0.1410 30 H 4.1463 0.2335 1.0833 H 1 UNL1 0.2415 @BOND 1 6 5 1 2 24 12 1 3 2 11 2 4 29 14 1 5 25 12 1 6 28 14 1 7 5 15 1 8 19 8 1 9 23 4 1 10 12 26 1 11 12 10 1 12 14 27 1 13 14 1 1 14 20 8 1 15 11 1 1 16 11 9 1 17 8 10 1 18 8 7 1 19 4 9 1 20 4 13 am 21 15 13 1 22 15 30 1 23 10 22 1 24 10 21 1 25 9 7 1 26 9 18 1 27 13 3 2 28 7 16 1 29 7 17 1