@MOLECULE 5-hydroxy-2-(3-hydroxy-4-oxidophenyl)-4-oxo-4h-chromen-7-olate 31 33 0 0 0 SMALL USER_CHARGES @ATOM 1 C -2.1046 -1.8242 0.0395 C.ar 1 UNL11111111 -0.4251 2 O -4.0036 -3.1541 0.0307 O.3 1 UNL11111111 -0.4515 3 C -3.5061 -1.9009 0.0231 C.ar 1 UNL11111111 0.4333 4 O -4.5298 1.5455 -0.0368 O.3 1 UNL11111111 -0.4567 5 C -4.3365 -0.7784 -0.0015 C.ar 1 UNL11111111 -0.4922 6 O -2.2995 2.9618 -0.0388 O.2 1 UNL11111111 -0.5387 7 C -3.7294 0.4822 -0.0133 C.ar 1 UNL11111111 0.4779 8 O -0.1866 -0.5201 0.0382 O.3 1 UNL11111111 -0.2707 9 C -2.3208 0.6197 -0.0022 C.ar 1 UNL11111111 -0.4924 10 O 4.1843 -2.3261 -0.0911 O.3 1 UNL11111111 -0.4338 11 C -1.5516 -0.5504 0.0252 C.ar 1 UNL11111111 0.3823 12 O 6.0111 -0.0212 0.0221 O.3 1 UNL11111111 -0.4351 13 C -1.6657 1.9151 -0.0209 C.2 1 UNL11111111 0.5532 14 C -0.2091 1.8718 -0.0201 C.2 1 UNL11111111 -0.4269 15 C 0.4513 0.6968 0.0077 C.2 1 UNL11111111 0.3129 16 C 1.8973 0.4734 0.0095 C.ar 1 UNL11111111 -0.0889 17 C 2.4050 -0.8299 -0.0446 C.ar 1 UNL11111111 -0.1248 18 C 3.7832 -1.0242 -0.0408 C.ar 1 UNL11111111 0.1134 19 C 4.6556 0.0747 0.0130 C.ar 1 UNL11111111 0.1713 20 C 4.1487 1.3736 0.0638 C.ar 1 UNL11111111 -0.1930 21 C 2.7719 1.5665 0.0641 C.ar 1 UNL11111111 -0.1040 22 H -1.4958 -2.7217 0.0605 H 1 UNL11111111 0.2043 23 H -4.9958 -3.1703 0.0156 H 1 UNL11111111 0.3366 24 H -3.9773 2.4146 -0.0447 H 1 UNL11111111 0.3898 25 H -5.4168 -0.8562 -0.0117 H 1 UNL11111111 0.1940 26 H 5.1653 -2.4159 -0.0965 H 1 UNL11111111 0.3067 27 H 6.3254 -0.9550 -0.0177 H 1 UNL11111111 0.3109 28 H 0.2965 2.8347 -0.0462 H 1 UNL11111111 0.2012 29 H 1.7472 -1.7029 -0.0898 H 1 UNL11111111 0.1950 30 H 4.8386 2.2167 0.1028 H 1 UNL11111111 0.1821 31 H 2.3787 2.5842 0.1083 H 1 UNL11111111 0.1690 @BOND 1 26 10 1 2 10 18 1 3 29 17 1 4 28 14 1 5 24 4 1 6 17 18 ar 7 17 16 ar 8 18 19 ar 9 6 13 2 10 4 7 1 11 13 14 1 12 13 9 1 13 14 15 2 14 27 12 1 15 7 9 ar 16 7 5 ar 17 25 5 1 18 9 11 ar 19 5 3 ar 20 15 16 1 21 15 8 1 22 16 21 ar 23 19 12 1 24 19 20 ar 25 23 2 1 26 3 2 1 27 3 1 ar 28 11 8 1 29 11 1 ar 30 1 22 1 31 20 21 ar 32 20 30 1 33 21 31 1