HMDB0034365 RDKit 3D L-Theanine 26 25 0 0 0 0 0 0 0 0999 V2000 -4.0444 0.6780 -0.4428 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5604 -0.7519 -0.6231 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1864 -0.7967 -1.0560 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1315 -0.2422 -0.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3999 0.3112 0.8085 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2807 -0.2768 -0.7148 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1879 0.3828 0.2838 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6258 0.3304 -0.1796 C 0 0 2 0 0 0 0 0 0 0 0 0 3.0478 -1.0320 -0.3426 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4938 1.0406 0.7874 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2860 2.2475 1.0663 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5419 0.3530 1.3822 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9220 0.9476 0.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1248 0.6879 -0.6643 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4723 1.3773 -1.0855 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5983 -1.2699 0.3771 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2330 -1.2839 -1.2986 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9635 -1.2528 -1.9628 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3655 0.1862 -1.7208 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6023 -1.3442 -0.7871 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1015 -0.1460 1.2463 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8788 1.4580 0.3829 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6767 0.8200 -1.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7071 -1.6499 0.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8106 -1.4268 -1.2834 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0299 0.6526 2.2065 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 4 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 8 10 1 0 10 11 2 0 10 12 1 0 1 13 1 0 1 14 1 0 1 15 1 0 2 16 1 0 2 17 1 0 3 18 1 0 6 19 1 0 6 20 1 0 7 21 1 0 7 22 1 0 8 23 1 6 9 24 1 0 9 25 1 0 12 26 1 0 M END