HMDB0014905 RDKit 3D Benzquinamide 61 63 0 0 0 0 0 0 0 0999 V2000 -3.9689 -2.2991 0.6786 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5510 -1.4348 1.8529 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8324 -0.0522 1.6338 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1577 0.4234 2.0724 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0879 0.2500 0.9057 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9675 0.8944 1.0436 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3876 2.0779 0.8879 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6120 0.5585 0.6126 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6752 0.6091 1.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5774 0.0413 1.4201 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0415 -1.0476 2.1452 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9746 -1.9135 1.3333 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9244 -1.0521 0.5744 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2757 -1.3207 0.5237 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0827 -0.4609 -0.2082 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4366 -0.7292 -0.2595 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9840 -1.8264 0.3999 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5567 0.6305 -0.8672 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4001 1.4517 -1.5796 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0001 2.5822 -2.2894 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1937 0.8932 -0.8102 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3924 0.0376 -0.0822 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9327 0.2069 0.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4148 1.4986 -0.4764 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0948 1.3934 -0.5434 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4072 0.7320 -1.7557 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2271 1.3049 -2.7247 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5590 0.6166 -3.9991 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6712 2.4594 -2.4405 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3955 -2.0622 -0.2435 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8344 -3.3772 0.9276 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0380 -2.1851 0.4165 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4760 -1.5951 2.0206 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1236 -1.8149 2.7325 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5027 -0.2233 2.8971 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0899 1.4913 2.3694 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7293 -0.6329 1.0934 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5125 0.1183 -0.0552 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7669 1.1474 0.8164 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6321 -0.5195 0.2795 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4781 1.7137 1.9528 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0803 0.1377 2.6669 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6346 -0.6877 3.0343 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1810 -1.6665 2.4952 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4079 -2.5553 0.6026 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4956 -2.5927 2.0376 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6367 -2.1806 1.0524 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4093 -2.7398 0.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1504 -1.6321 1.4805 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0103 -2.0208 -0.0183 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7510 3.4605 -1.6804 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7147 2.8172 -3.1275 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0485 2.3043 -2.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7805 1.7554 -1.3308 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4338 -0.6154 -0.5264 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7593 1.6595 -1.5222 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6736 2.3559 0.1771 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5787 2.3944 -0.4856 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5319 0.1337 -3.8625 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5065 1.2779 -4.8782 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7983 -0.1911 -4.1599 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 1 0 3 6 1 0 6 7 2 0 6 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 2 0 14 15 1 0 15 16 1 0 16 17 1 0 15 18 2 0 18 19 1 0 19 20 1 0 18 21 1 0 21 22 2 0 22 23 1 0 23 24 1 0 24 25 1 0 25 26 1 0 26 27 1 0 27 28 1 0 27 29 2 0 25 8 1 0 23 10 1 0 22 13 1 0 1 30 1 0 1 31 1 0 1 32 1 0 2 33 1 0 2 34 1 0 4 35 1 0 4 36 1 0 5 37 1 0 5 38 1 0 5 39 1 0 8 40 1 0 9 41 1 0 9 42 1 0 11 43 1 0 11 44 1 0 12 45 1 0 12 46 1 0 14 47 1 0 17 48 1 0 17 49 1 0 17 50 1 0 20 51 1 0 20 52 1 0 20 53 1 0 21 54 1 0 23 55 1 0 24 56 1 0 24 57 1 0 25 58 1 0 28 59 1 0 28 60 1 0 28 61 1 0 M END