HMDB0243730 RDKit 3D (S)-Gatifloxacin 49 52 0 0 0 0 0 0 0 0999 V2000 0.2529 0.0062 -2.6359 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2520 0.6170 -1.3556 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3475 -0.0921 -0.1674 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8566 -0.5366 0.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1208 -0.3010 -0.2208 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7415 -1.1856 -1.1573 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1273 -1.6073 -0.6776 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6509 -0.6192 0.2563 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3176 0.7324 -0.0786 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0946 1.6460 0.8322 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8234 0.9284 0.1799 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8070 -1.2542 1.5525 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9925 -1.6980 2.0873 F 0 0 0 0 0 0 0 0 0 0 0 0 0.3932 -1.5016 2.1553 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5863 -1.0548 1.6187 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7808 -1.3027 2.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7998 -1.9650 3.3247 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9279 -0.8192 1.6524 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2040 -1.0696 2.2891 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2535 -1.7143 3.3512 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3603 -0.5917 1.7148 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8408 -0.1050 0.4698 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6749 0.1384 -0.1375 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7453 0.9150 -1.3416 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8002 2.0726 -1.2047 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3914 2.3176 -1.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5479 -0.3274 0.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7575 0.6469 -3.4025 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7821 -0.9519 -2.5884 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7630 -0.1860 -3.0184 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8942 -0.6936 -2.1442 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1486 -2.1056 -1.3012 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0801 -2.5683 -0.1222 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8027 -1.7048 -1.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6756 -0.7226 0.3309 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5494 0.9992 -1.1297 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4779 2.5438 0.3079 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5069 1.9481 1.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0023 1.1237 1.2494 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4260 1.8116 -0.3427 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7028 1.0418 1.2803 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4242 -2.0619 3.0791 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0112 -1.1900 1.2189 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7966 0.2611 0.0432 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0175 0.2688 -2.2363 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5852 2.1255 -1.9517 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1427 2.3204 -0.1852 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1573 2.6387 -2.5456 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7289 2.8266 -0.7690 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 4 5 1 0 5 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 1 0 9 11 1 0 4 12 1 0 12 13 1 0 12 14 2 0 14 15 1 0 15 16 1 0 16 17 2 0 16 18 1 0 18 19 1 0 19 20 2 0 19 21 1 0 18 22 2 0 22 23 1 0 23 24 1 0 24 25 1 0 25 26 1 0 23 27 1 0 27 3 1 0 11 5 1 0 27 15 2 0 26 24 1 0 1 28 1 0 1 29 1 0 1 30 1 0 6 31 1 0 6 32 1 0 7 33 1 0 7 34 1 0 8 35 1 0 9 36 1 0 10 37 1 0 10 38 1 0 10 39 1 0 11 40 1 0 11 41 1 0 14 42 1 0 21 43 1 0 22 44 1 0 24 45 1 0 25 46 1 0 25 47 1 0 26 48 1 0 26 49 1 0 M END