HMDB0013302 RDKit 3D Phenylalanylphenylalanine 43 44 0 0 0 0 0 0 0 0999 V2000 1.3682 -2.1937 2.7586 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0119 -1.0667 2.0639 C 0 0 1 0 0 0 0 0 0 0 0 0 3.0510 -1.6505 1.1695 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8108 -0.6777 0.3834 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9775 -0.0746 0.7961 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6501 0.8369 0.0057 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1676 1.1707 -1.2286 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0075 0.5886 -1.6711 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3356 -0.3314 -0.8645 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9631 -0.3066 1.3902 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2617 0.7346 0.7127 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4102 -0.6700 1.4473 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4460 0.0934 0.7734 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.1095 -0.7042 -0.3095 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1662 0.0629 -1.0023 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4824 0.0166 -0.5942 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4938 0.7257 -1.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2036 1.5231 -2.3113 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8905 1.5782 -2.7299 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8822 0.8740 -2.1055 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3738 0.7190 1.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1803 0.5000 2.9693 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4427 1.5295 1.4123 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7173 -1.8161 3.4837 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9231 -2.8387 2.0997 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4676 -0.4083 2.8375 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7586 -2.2263 1.8075 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5524 -2.3662 0.4803 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3713 -0.3273 1.7679 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5640 1.3040 0.3387 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6663 1.8804 -1.8767 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6344 0.8649 -2.6584 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4297 -0.7430 -1.2888 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6576 -1.5199 1.9998 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9203 0.9483 0.2549 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3615 -1.1038 -1.0284 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6211 -1.6102 0.1167 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7236 -0.6116 0.2644 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5321 0.6638 -0.8698 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9664 2.0902 -2.8272 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6789 2.2074 -3.5835 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8507 0.9124 -2.4281 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2963 1.4222 1.9343 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 5 6 1 0 6 7 2 0 7 8 1 0 8 9 2 0 2 10 1 0 10 11 2 0 10 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 2 0 16 17 1 0 17 18 2 0 18 19 1 0 19 20 2 0 13 21 1 0 21 22 2 0 21 23 1 0 9 4 1 0 20 15 1 0 1 24 1 0 1 25 1 0 2 26 1 1 3 27 1 0 3 28 1 0 5 29 1 0 6 30 1 0 7 31 1 0 8 32 1 0 9 33 1 0 12 34 1 0 13 35 1 6 14 36 1 0 14 37 1 0 16 38 1 0 17 39 1 0 18 40 1 0 19 41 1 0 20 42 1 0 23 43 1 0 M END