@MOLECULE (E)-isohexyl(propyl)diazene 31 30 0 0 0 SMALL USER_CHARGES @ATOM 1 C 5.2114 1.2376 -0.1977 C.3 1 UNL11111111 -0.4395 2 C 3.8041 0.9167 0.2974 C.3 1 UNL11111111 -0.2495 3 C 3.3922 -0.4982 -0.1487 C.3 1 UNL11111111 -0.1589 4 N 2.0708 -0.7839 0.4383 N.2 1 UNL11111111 -0.1892 5 N 1.1742 -1.0793 -0.3715 N.2 1 UNL11111111 -0.1867 6 C -0.1475 -1.3576 0.2216 C.3 1 UNL11111111 -0.1593 7 C -1.1453 -0.3434 -0.3653 C.3 1 UNL11111111 -0.2709 8 C -2.5379 -0.5631 0.2334 C.3 1 UNL11111111 -0.2881 9 C -3.5636 0.4319 -0.3452 C.3 1 UNL11111111 -0.0547 10 C -4.9822 -0.0077 0.0416 C.3 1 UNL11111111 -0.4582 11 C -3.3052 1.8532 0.1683 C.3 1 UNL11111111 -0.4538 12 H 5.5183 2.2440 0.1118 H 1 UNL11111111 0.1463 13 H 5.9510 0.5340 0.2016 H 1 UNL11111111 0.1449 14 H 5.2736 1.1997 -1.2916 H 1 UNL11111111 0.1450 15 H 3.7526 0.9934 1.4017 H 1 UNL11111111 0.1513 16 H 3.0794 1.6590 -0.0891 H 1 UNL11111111 0.1440 17 H 3.4275 -0.5858 -1.2560 H 1 UNL11111111 0.1474 18 H 4.0963 -1.2574 0.2620 H 1 UNL11111111 0.1572 19 H -0.4192 -2.3954 -0.0780 H 1 UNL11111111 0.1569 20 H -0.1613 -1.3219 1.3327 H 1 UNL11111111 0.1476 21 H -0.7954 0.6870 -0.1611 H 1 UNL11111111 0.1484 22 H -1.1752 -0.4378 -1.4680 H 1 UNL11111111 0.1517 23 H -2.8726 -1.5986 0.0318 H 1 UNL11111111 0.1382 24 H -2.5025 -0.4653 1.3345 H 1 UNL11111111 0.1411 25 H -3.4794 0.4296 -1.4588 H 1 UNL11111111 0.1303 26 H -5.1116 -0.0336 1.1287 H 1 UNL11111111 0.1447 27 H -5.7334 0.6798 -0.3615 H 1 UNL11111111 0.1425 28 H -5.2114 -1.0061 -0.3447 H 1 UNL11111111 0.1412 29 H -4.0566 2.5541 -0.2107 H 1 UNL11111111 0.1413 30 H -3.3369 1.8965 1.2622 H 1 UNL11111111 0.1449 31 H -2.3243 2.2233 -0.1482 H 1 UNL11111111 0.1438 @BOND 1 22 7 1 2 25 9 1 3 14 1 1 4 17 3 1 5 5 6 1 6 5 4 2 7 7 21 1 8 7 6 1 9 7 8 1 10 27 10 1 11 9 10 1 12 9 11 1 13 9 8 1 14 28 10 1 15 29 11 1 16 1 12 1 17 1 13 1 18 1 2 1 19 3 18 1 20 3 2 1 21 3 4 1 22 31 11 1 23 16 2 1 24 19 6 1 25 23 8 1 26 10 26 1 27 11 30 1 28 6 20 1 29 8 24 1 30 2 15 1