@MOLECULE (3e)-3-({4-[(carboxymethyl)carbamoyl]phenyl}hydrazono)-6-oxo-1,4-cyclohexadiene-1-carboxylic acid 38 39 0 0 0 SMALL GASTEIGER @ATOM 1 O -5.2892 1.2495 1.3618 O.2 1 UNL1111111111 -0.5067 2 O 7.1637 0.8015 -0.1997 O.2 1 UNL1111111111 -0.3876 3 O 5.6319 -2.4869 1.1744 O.3 1 UNL1111111111 -0.5668 4 O -6.3312 -1.3900 -1.7605 O.3 1 UNL1111111111 -0.5715 5 O 6.9525 -2.1996 -0.6001 O.2 1 UNL1111111111 -0.4559 6 O -8.3712 -0.8781 -1.0181 O.2 1 UNL1111111111 -0.4814 7 N 0.9205 1.3797 -0.1371 N.pl3 1 UNL1111111111 -0.3208 8 N -5.0980 -0.8288 0.4865 N.am 1 UNL1111111111 -0.5771 9 N 1.8104 0.4079 0.0135 N.2 1 UNL1111111111 -0.0950 10 C -3.1318 0.6080 0.5909 C.ar 1 UNL1111111111 -0.1805 11 C -0.4386 1.0771 0.1226 C.ar 1 UNL1111111111 0.2372 12 C -2.7215 1.8469 0.0943 C.ar 1 UNL1111111111 -0.0303 13 C -2.1957 -0.3873 0.8728 C.ar 1 UNL1111111111 -0.0686 14 C -1.3752 2.0895 -0.1486 C.ar 1 UNL1111111111 -0.2662 15 C -0.8453 -0.1624 0.6377 C.ar 1 UNL1111111111 -0.2127 16 C -4.5807 0.4113 0.8440 C.2 1 UNL1111111111 0.5849 17 C 3.0950 0.5857 -0.2072 C.2 1 UNL1111111111 -0.0475 18 C 3.9040 -0.6132 0.0239 C.2 1 UNL1111111111 0.0369 19 C 5.2459 -0.5699 -0.0702 C.2 1 UNL1111111111 -0.2720 20 C 3.7843 1.7942 -0.6501 C.2 1 UNL1111111111 -0.1284 21 C 5.9691 0.6942 -0.3284 C.2 1 UNL1111111111 0.4642 22 C -6.5341 -1.0482 0.5760 C.3 1 UNL1111111111 -0.1358 23 C 5.1223 1.8460 -0.7208 C.2 1 UNL1111111111 -0.2260 24 C 6.0622 -1.7820 0.0873 C.2 1 UNL1111111111 0.6556 25 C -7.2116 -1.0700 -0.7775 C.2 1 UNL1111111111 0.6078 26 H -3.4650 2.6283 -0.0950 H 1 UNL1111111111 0.1762 27 H -2.5175 -1.3431 1.2917 H 1 UNL1111111111 0.1626 28 H -1.0615 3.0543 -0.5396 H 1 UNL1111111111 0.1672 29 H -0.1079 -0.9373 0.8550 H 1 UNL1111111111 0.1911 30 H 1.1736 2.3121 -0.4552 H 1 UNL1111111111 0.3001 31 H 3.3665 -1.5390 0.2697 H 1 UNL1111111111 0.1846 32 H -4.5822 -1.4590 -0.1120 H 1 UNL1111111111 0.3230 33 H 3.1747 2.6523 -0.9299 H 1 UNL1111111111 0.1465 34 H -6.7339 -2.0208 1.0941 H 1 UNL1111111111 0.1773 35 H -7.0163 -0.2497 1.2098 H 1 UNL1111111111 0.2152 36 H 5.6681 2.7295 -1.0542 H 1 UNL1111111111 0.1829 37 H 6.1623 -3.3028 1.3462 H 1 UNL1111111111 0.3541 38 H -6.7339 -1.4058 -2.6647 H 1 UNL1111111111 0.3633 @BOND 1 1 16 2 2 2 21 2 3 3 24 1 4 3 37 1 5 4 25 1 6 4 38 1 7 5 24 2 8 6 25 2 9 7 9 1 10 7 11 1 11 7 30 1 12 8 16 am 13 8 22 1 14 8 32 1 15 9 17 2 16 10 12 ar 17 10 13 ar 18 10 16 1 19 11 14 ar 20 11 15 ar 21 12 14 ar 22 12 26 1 23 13 15 ar 24 13 27 1 25 14 28 1 26 15 29 1 27 17 18 1 28 17 20 1 29 18 19 2 30 18 31 1 31 19 21 1 32 19 24 1 33 20 23 2 34 20 33 1 35 21 23 1 36 22 25 1 37 22 34 1 38 22 35 1 39 23 36 1