@MOLECULE (8z)-7-oxo-8-({4-[(e)-phenyldiazenyl]phenyl}hydrazono)-7,8-dihydro-1,3-naphthalenedisulfonic acid 35 36 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 S 0.4831 0.6742 -0.2459 S.3 1 UNL1 2.3812 2 S 4.4540 3.6488 -0.8300 S.3 1 UNL1 2.3603 3 O 0.2672 2.0868 -0.3158 O.3 1 UNL1 -0.8441 4 O 3.2524 1.0014 3.5451 O.2 1 UNL1 -0.1759 5 O -0.0126 -0.2361 -1.2336 O.3 1 UNL1 -0.8601 6 O -0.4133 0.1712 1.1929 O.3 1 UNL1 -0.5447 7 O 3.2415 -4.3356 -0.5854 O.2 1 UNL1 -0.3548 8 O 5.8710 3.6002 -0.8020 O.2 1 UNL1 -0.7679 9 O 3.7813 4.8353 -1.2100 O.3 1 UNL1 -0.7452 10 N 2.3341 -1.9033 -1.6390 N.pl3 1 UNL1 -0.3482 11 N 1.2208 -2.4399 -1.8640 N.3 1 UNL1 0.2699 12 N -4.4236 -2.3539 -0.3236 N.2 1 UNL1 -0.1827 13 N -5.3235 -1.9003 0.5461 N.pl3 1 UNL1 0.0067 14 C 2.6886 -0.8737 0.5445 C.2 1 UNL1 0.1533 15 C 3.2496 -0.8808 1.9244 C.2 1 UNL1 -0.3127 16 C 2.1356 0.4124 0.1335 C.3 1 UNL1 -0.6879 17 C 3.6591 2.4239 -0.4165 C.1 1 UNL1 -0.8921 18 C 3.2368 0.1339 2.7890 C.1 1 UNL1 0.5557 19 C 2.9455 1.4348 -0.1385 C.1 1 UNL1 0.5251 20 C 2.7403 -1.9753 -0.2707 C.2 1 UNL1 -0.0503 21 C 3.7713 -2.1553 2.1649 C.2 1 UNL1 -0.0128 22 C 3.3046 -3.3722 0.1187 C.2 1 UNL1 0.4897 23 C 3.8000 -3.1461 1.4297 C.2 1 UNL1 -0.1728 24 C 0.1642 -2.9393 -2.0001 C.3 1 UNL1 -0.0257 25 C -1.1709 -2.9362 -1.7560 C.1 1 UNL1 0.0285 26 C -1.4492 -0.5121 0.8584 C.1 1 UNL1 0.2705 27 C -2.2320 -2.7201 -1.1940 C.1 1 UNL1 -0.0355 28 C -2.3848 -1.1803 0.4565 C.1 1 UNL1 -0.2836 29 C -3.1552 -2.0985 -0.3048 C.2 1 UNL1 0.2892 30 C -6.0297 -0.8823 0.3764 C.1 1 UNL1 -0.0781 31 C -10.1665 4.0062 0.1489 C.1 1 UNL1 0.4419 32 C -6.8516 0.1014 0.3241 C.1 1 UNL1 0.2256 33 C -9.3315 3.0283 0.1953 C.1 1 UNL1 -0.7290 34 C -7.6752 1.0766 0.2853 C.1 1 UNL1 -0.3759 35 C -8.5025 2.0526 0.2406 C.1 1 UNL1 0.4823 @BOND 1 24 11 1 2 24 25 1 3 11 10 1 4 25 27 3 5 10 20 1 6 5 1 1 7 9 2 1 8 27 29 1 9 2 8 2 10 2 17 1 11 7 22 2 12 17 19 3 13 12 29 2 14 12 13 1 15 3 1 1 16 29 28 1 17 20 22 1 18 20 14 2 19 1 16 1 20 1 6 1 21 19 16 1 22 22 23 1 23 16 14 1 24 31 33 3 25 33 35 1 26 35 34 3 27 34 32 1 28 32 30 3 29 30 13 1 30 28 26 3 31 14 15 1 32 26 6 1 33 23 21 2 34 15 21 1 35 15 18 2 36 18 4 2