HMDB0254753 RDKit 3D Miroprofen 34 36 0 0 0 0 0 0 0 0999 V2000 -4.4731 1.2234 1.5059 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2207 0.6387 0.1362 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8001 -0.7187 0.0055 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6382 -0.9702 -0.8946 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4379 -1.7396 0.8636 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.7530 0.5261 -0.0327 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0564 -0.2033 0.9254 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6916 -0.3699 0.8609 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0035 0.2022 -0.1821 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4524 0.0444 -0.2797 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2948 -0.6407 0.5762 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5745 -0.5690 0.1653 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7503 -1.0423 0.6171 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9544 -0.8204 -0.0071 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9496 -0.0673 -1.1643 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7440 0.4103 -1.6159 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5429 0.1710 -0.9656 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2770 0.5390 -1.2343 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6694 0.9282 -1.1404 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0578 1.0878 -1.0597 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0201 2.1835 1.4599 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0438 0.5356 2.1583 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5238 1.4416 2.0566 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6118 1.2867 -0.6838 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2026 -2.6721 0.5515 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5747 -0.6622 1.7548 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2118 -0.9481 1.6373 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9456 -1.1646 1.4641 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7588 -1.6320 1.5222 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9031 -1.2062 0.3634 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8769 0.1403 -1.7016 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7101 1.0075 -2.5265 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1788 1.4026 -1.9849 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5727 1.6579 -1.8153 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 3 5 1 0 2 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 1 0 13 14 2 0 14 15 1 0 15 16 2 0 16 17 1 0 17 18 2 0 9 19 1 0 19 20 2 0 20 6 1 0 18 10 1 0 17 12 1 0 1 21 1 0 1 22 1 0 1 23 1 0 2 24 1 0 5 25 1 0 7 26 1 0 8 27 1 0 11 28 1 0 13 29 1 0 14 30 1 0 15 31 1 0 16 32 1 0 19 33 1 0 20 34 1 0 M END