HMDB0013948 RDKit 3D 5'-Hydroxycarvedilol 57 60 0 0 0 0 0 0 0 0999 V2000 7.6365 -0.7822 -3.1328 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5783 -0.6495 -2.2029 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7332 -0.7590 -0.8505 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9541 -1.0104 -0.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1439 -1.1283 1.0795 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0681 -0.9885 1.9244 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2457 -1.1070 3.3143 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8341 -0.7350 1.3824 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6351 -0.6172 0.0246 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4389 -0.3713 -0.5560 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1610 -0.1969 -0.0944 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5121 -1.3369 0.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1827 -1.0150 1.0379 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2142 -0.8349 0.0192 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1562 -0.4588 0.5903 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5485 -1.4764 1.4232 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0820 -0.2757 -0.6013 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3431 0.0469 -0.3343 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4930 -0.2767 0.2251 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7826 -1.4428 0.8997 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0092 -1.7343 1.4693 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0051 -0.7882 1.3489 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7886 0.3967 0.6896 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5597 1.4717 0.4295 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.8848 2.3921 -0.2573 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2001 3.6546 -0.7679 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2507 4.3760 -1.4527 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9864 3.8529 -1.6352 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6517 2.6188 -1.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6155 1.8993 -0.4563 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5632 0.6474 0.1408 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1201 -1.7443 -2.9325 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3218 -0.6248 -4.1637 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3862 0.0272 -2.9043 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8078 -1.1195 -0.9573 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1213 -1.3276 1.5141 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1557 -2.0236 3.7771 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0237 -0.6159 2.0941 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5311 0.0970 -1.0023 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1078 0.7331 0.5606 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0789 -1.6185 1.5008 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5483 -2.2178 -0.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1273 -0.4163 1.8586 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1657 -1.7079 -0.6275 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5222 0.0404 -0.6139 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0703 0.5220 1.1205 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6255 -2.3018 0.8604 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9282 -1.2230 -1.2025 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5294 0.4959 -1.2448 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0383 -2.2070 1.0007 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1484 -2.6733 1.9817 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9771 -0.9988 1.7895 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5390 1.5390 0.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2037 4.0351 -0.6049 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4737 5.3659 -1.8608 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2341 4.4190 -2.1757 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6675 2.1743 -1.2690 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 2 0 6 7 1 0 6 8 1 0 8 9 2 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 15 17 1 0 17 18 1 0 18 19 1 0 19 20 2 0 20 21 1 0 21 22 2 0 22 23 1 0 23 24 1 0 24 25 1 0 25 26 2 0 26 27 1 0 27 28 2 0 28 29 1 0 29 30 2 0 30 31 1 0 9 3 1 0 31 19 1 0 31 23 2 0 30 25 1 0 1 32 1 0 1 33 1 0 1 34 1 0 4 35 1 0 5 36 1 0 7 37 1 0 8 38 1 0 11 39 1 0 11 40 1 0 12 41 1 0 12 42 1 0 13 43 1 0 14 44 1 0 14 45 1 0 15 46 1 0 16 47 1 0 17 48 1 0 17 49 1 0 20 50 1 0 21 51 1 0 22 52 1 0 24 53 1 0 26 54 1 0 27 55 1 0 28 56 1 0 29 57 1 0 M END