HMDB0033139 RDKit 3D Sulfaquinoxaline 33 35 0 0 0 0 0 0 0 0999 V2000 4.4753 2.2708 -0.1669 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6200 1.1960 0.1853 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9015 -0.1154 -0.1535 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0468 -1.1359 0.2056 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8686 -0.9084 0.9193 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8190 -2.2390 1.3561 S 0 0 0 0 0 6 0 0 0 0 0 0 1.6578 -3.4625 1.6837 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1462 -1.8517 2.6453 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3186 -2.6122 0.1279 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2811 -1.6879 -0.3065 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1758 -2.0422 -1.3034 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0929 -1.1611 -1.7170 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1310 0.0666 -1.1521 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0589 1.0046 -1.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1203 2.2614 -0.9902 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2475 2.6362 -0.0034 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3101 1.6967 0.4004 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2489 0.4379 -0.1585 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3337 -0.4463 0.2520 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6038 0.4039 1.2487 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4569 1.4277 0.8910 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1495 3.0169 -0.8153 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4443 2.3506 0.2049 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8140 -0.3223 -0.7104 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2511 -2.1818 -0.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2903 -3.5558 -0.3064 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0884 -3.0398 -1.7104 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7564 0.7160 -2.3312 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8533 2.9955 -1.3062 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2668 3.6250 0.4622 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6264 2.0222 1.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7026 0.6414 1.8065 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2431 2.4706 1.1546 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 3 4 1 0 4 5 2 0 5 6 1 0 6 7 2 0 6 8 2 0 6 9 1 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 15 16 1 0 16 17 2 0 17 18 1 0 18 19 2 0 5 20 1 0 20 21 2 0 21 2 1 0 19 10 1 0 18 13 1 0 1 22 1 0 1 23 1 0 3 24 1 0 4 25 1 0 9 26 1 0 11 27 1 0 14 28 1 0 15 29 1 0 16 30 1 0 17 31 1 0 20 32 1 0 21 33 1 0 M END