HMDB0061130 RDKit 3D 8-Hydroxynevirapine glucuronide 55 59 0 0 0 0 0 0 0 0999 V2000 -5.9053 0.4497 2.8683 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6421 0.5717 1.4054 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5733 1.0733 0.5199 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2966 1.1742 -0.8439 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0913 0.7665 -1.2698 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.1620 0.2742 -0.4404 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4161 0.1639 0.9288 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5357 -0.3284 1.9609 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1106 -0.4237 1.9273 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5126 -0.7170 2.9840 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2484 -0.2087 0.7537 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0807 -0.1623 1.0684 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0529 0.0322 0.0862 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3803 0.0740 0.4343 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4468 0.2590 -0.4239 C 0 0 1 0 0 0 0 0 0 0 0 0 4.1749 1.4180 -0.1643 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2568 1.2805 0.6508 C 0 0 1 0 0 0 0 0 0 0 0 0 4.8797 1.0953 2.0898 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6849 1.0758 2.4843 O 0 0 0 0 0 0 0 0 0 0 0 0 5.8461 0.9332 3.0757 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3015 0.3056 0.2134 C 0 0 2 0 0 0 0 0 0 0 0 0 7.5085 0.8958 -0.1388 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7116 -0.4693 -0.9712 C 0 0 1 0 0 0 0 0 0 0 0 0 6.5375 -1.5290 -1.3318 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3642 -0.9593 -0.4839 C 0 0 2 0 0 0 0 0 0 0 0 0 3.9046 -1.8857 -1.4212 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5865 0.1712 -1.1972 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7403 0.1243 -1.5068 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6554 -0.0615 -0.5612 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9878 -0.0786 -1.1162 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0634 -0.4873 -2.4727 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2616 -0.7418 -3.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4450 -1.9292 -2.7204 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8569 0.9800 3.0998 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1104 0.9668 3.4402 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0347 -0.6041 3.1493 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5280 1.3889 0.9041 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0680 1.5756 -1.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0144 -0.6390 2.8084 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4129 -0.2751 2.0862 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0846 0.3778 -1.4582 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7668 2.2926 0.6396 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4272 1.7279 3.3537 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5071 -0.4815 0.9881 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1420 0.7775 0.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5660 0.2484 -1.8008 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3949 -1.1281 -1.6338 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4647 -1.4047 0.5261 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9295 -1.7284 -1.5149 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2788 0.3282 -2.0383 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1398 -0.2011 -3.0546 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2913 -0.7887 -2.9184 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1814 -0.5435 -4.3668 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8672 -2.5202 -1.8813 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9524 -2.5060 -3.5036 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 7 8 1 0 8 9 1 0 9 10 2 0 9 11 1 0 11 12 2 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 17 18 1 0 18 19 2 0 18 20 1 0 17 21 1 0 21 22 1 0 21 23 1 0 23 24 1 0 23 25 1 0 25 26 1 0 13 27 2 0 27 28 1 0 28 29 2 0 29 30 1 0 30 31 1 0 31 32 1 0 32 33 1 0 7 2 1 0 29 11 1 0 33 31 1 0 30 6 1 0 25 15 1 0 1 34 1 0 1 35 1 0 1 36 1 0 3 37 1 0 4 38 1 0 8 39 1 0 12 40 1 0 15 41 1 6 17 42 1 1 20 43 1 0 21 44 1 1 22 45 1 0 23 46 1 6 24 47 1 0 25 48 1 1 26 49 1 0 27 50 1 0 31 51 1 0 32 52 1 0 32 53 1 0 33 54 1 0 33 55 1 0 M END