HMDB0014955 RDKit 3D Rosoxacin 36 38 0 0 0 0 0 0 0 0999 V2000 -1.3725 2.9891 0.0122 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4804 1.9506 1.1010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7436 0.6467 0.5461 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0365 0.2415 0.3745 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3665 -0.9849 -0.1437 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7521 -1.3889 -0.3141 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0474 -2.5059 -0.7809 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7895 -0.5368 0.0405 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3398 -1.8173 -0.4951 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5731 -2.9417 -0.9700 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0420 -1.3920 -0.3153 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0310 -2.2265 -0.6688 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2702 -1.8522 -0.5115 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6444 -0.6199 0.0089 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0563 -0.2525 0.1641 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9846 -0.7299 -0.7148 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3337 -0.4229 -0.6270 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7300 0.3825 0.3747 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8246 0.8622 1.2512 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4811 0.5672 1.1782 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6102 0.2209 0.3651 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7189 -0.1480 0.2103 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3156 3.5883 -0.1061 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5190 3.6424 0.2403 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1466 2.4558 -0.9444 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6685 1.9655 1.8345 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3955 2.2465 1.6989 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8184 0.9338 0.6665 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2794 -0.6237 0.9354 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2207 -3.2073 -1.0827 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0677 -2.5212 -0.7945 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6985 -1.3822 -1.5344 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0873 -0.7870 -1.3089 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2198 1.5078 2.0355 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7999 0.9700 1.8947 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8490 1.1703 0.7651 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 2 0 5 6 1 0 6 7 2 0 6 8 1 0 5 9 1 0 9 10 2 0 9 11 1 0 11 12 2 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 18 19 1 0 19 20 2 0 14 21 1 0 21 22 2 0 22 3 1 0 22 11 1 0 20 15 1 0 1 23 1 0 1 24 1 0 1 25 1 0 2 26 1 0 2 27 1 0 4 28 1 0 8 29 1 0 12 30 1 0 13 31 1 0 16 32 1 0 17 33 1 0 19 34 1 0 20 35 1 0 21 36 1 0 M END