HMDB0258504 RDKit 3D 7-Oxo-7h-Benzimidazo[2,1-A]benz[de]isoquinoline-3-Carboxylic Acid 34 38 0 0 0 0 0 0 0 0999 V2000 5.1382 -0.7877 -2.3494 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6999 -0.6551 -1.1498 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6434 -0.7007 -0.1806 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2877 -0.4800 -1.0186 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4609 -0.4593 -2.1537 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1065 -0.2936 -2.0615 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4479 -0.1353 -0.8653 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2360 -0.1517 0.2665 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6195 -0.3194 0.1948 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3155 -0.3213 1.3798 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6682 -0.1629 2.5977 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3053 -0.0012 2.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5568 0.0088 1.4578 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8181 0.1726 1.4870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4209 0.3168 2.5708 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5589 0.1838 0.3605 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8856 0.3269 0.1672 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9770 0.5117 1.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2614 0.6298 0.5101 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4886 0.5647 -0.8496 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4019 0.3807 -1.6805 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1115 0.2617 -1.1915 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9014 0.0816 -1.7490 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9300 0.0300 -0.8193 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3012 0.0543 -0.0002 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9476 -0.5816 -3.1164 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5288 -0.2879 -2.9844 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3805 -0.4487 1.3497 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2841 -0.1743 3.5024 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7847 0.1239 3.5601 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7932 0.5607 2.0469 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1303 0.7749 1.1435 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4786 0.6526 -1.2753 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5554 0.3255 -2.7648 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 2 4 1 0 4 5 2 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 13 14 1 0 14 15 2 0 14 16 1 0 16 17 1 0 17 18 2 0 18 19 1 0 19 20 2 0 20 21 1 0 21 22 2 0 22 23 1 0 23 24 2 0 9 4 1 0 24 16 1 0 24 7 1 0 13 8 1 0 22 17 1 0 3 25 1 0 5 26 1 0 6 27 1 0 10 28 1 0 11 29 1 0 12 30 1 0 18 31 1 0 19 32 1 0 20 33 1 0 21 34 1 0 M END