@MOLECULE 4-(2-aminoethyl)-6-diazo-1,3-cyclohexadien-1-ol 23 23 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 O 3.0134 1.1154 -0.3704 O.2 1 UNL1 -0.5049 2 N -4.5119 -0.7358 -0.3753 N.3 1 UNL1 -0.6533 3 N 2.2633 -1.3848 -0.0152 N.pl3 1 UNL1 0.3288 4 N 3.0430 -2.2045 -0.1076 N.3 1 UNL1 -0.1458 5 C -0.9916 0.3445 0.4438 C.2 1 UNL1 -0.0338 6 C -2.4249 0.0016 0.6956 C.3 1 UNL1 -0.2937 7 C -0.0503 -0.8256 0.4603 C.3 1 UNL1 -0.2083 8 C -3.1387 -0.2554 -0.6483 C.3 1 UNL1 -0.0878 9 C -0.5958 1.6102 0.2154 C.2 1 UNL1 -0.1282 10 C 1.3618 -0.4548 0.0957 C.2 1 UNL1 -0.2823 11 C 1.6884 0.9385 -0.1120 C.2 1 UNL1 0.3483 12 C 0.7842 1.9403 -0.0560 C.3 1 UNL1 -0.3646 13 H -2.9373 0.8112 1.2512 H 1 UNL1 0.1473 14 H -2.5275 -0.8954 1.3418 H 1 UNL1 0.1647 15 H -0.0675 -1.2836 1.4782 H 1 UNL1 0.1556 16 H -0.4330 -1.6082 -0.2360 H 1 UNL1 0.1547 17 H -3.1116 0.6624 -1.2728 H 1 UNL1 0.1118 18 H -2.6039 -1.0499 -1.2149 H 1 UNL1 0.1417 19 H -1.3024 2.4388 0.2224 H 1 UNL1 0.1498 20 H 1.0451 2.9783 -0.2068 H 1 UNL1 0.1642 21 H -4.9983 -0.9789 -1.2217 H 1 UNL1 0.2473 22 H -5.0566 -0.0575 0.1297 H 1 UNL1 0.2455 23 H 3.2431 2.0657 -0.5126 H 1 UNL1 0.3429 @BOND 1 17 8 1 2 21 2 1 3 18 8 1 4 8 2 1 5 8 6 1 6 23 1 1 7 2 22 1 8 1 11 1 9 16 7 1 10 20 12 1 11 11 12 1 12 11 10 2 13 4 3 1 14 12 9 1 15 3 10 1 16 10 7 1 17 9 19 1 18 9 5 2 19 5 7 1 20 5 6 1 21 7 15 1 22 6 13 1 23 6 14 1