HMDB0028716 RDKit 3D Arginylphenylalanine 46 46 0 0 0 0 0 0 0 0999 V2000 4.0509 -0.9933 1.9726 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5457 -0.0246 1.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3577 1.3170 1.6881 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3060 -0.3008 0.1183 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1572 0.4140 -1.1075 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8753 0.1475 -1.8045 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6236 0.4966 -1.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4749 0.1317 -2.0095 C 0 0 2 0 0 0 0 0 0 0 0 0 1.7101 0.9644 -3.1777 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1573 0.4141 -1.4557 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5447 1.3326 -1.9607 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3953 -0.2999 -0.3573 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7296 0.0293 0.1563 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.6610 -1.1475 0.0002 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0232 -0.9209 0.4649 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0064 -0.4051 -0.3508 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2741 -0.2132 0.1343 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6080 -0.5285 1.4518 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6334 -1.0384 2.2543 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3647 -1.2285 1.7614 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5454 0.4793 1.5417 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4287 0.5171 2.0808 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6440 0.8767 2.2771 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2138 -1.9871 1.6417 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8153 1.6509 2.5529 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7786 1.9520 1.1333 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0190 -1.0806 0.1614 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3433 1.5138 -0.9655 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9718 0.0636 -1.8105 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8703 -0.9566 -2.0553 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8168 0.7066 -2.7663 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5306 1.5903 -0.9106 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4997 0.0059 -0.0857 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6479 -0.9483 -2.2611 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1989 0.6279 -4.0248 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5241 1.9446 -2.9232 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1794 -1.0561 0.0594 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1738 0.8647 -0.4215 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2294 -2.0145 0.5639 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6868 -1.4520 -1.0549 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7995 -0.1403 -1.3974 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0722 0.1874 -0.4668 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5934 -0.3846 1.8475 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8543 -1.2965 3.2881 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6391 -1.6465 2.4596 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7614 1.8359 2.6116 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 3 2 3 1 0 2 4 1 0 4 5 1 0 5 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 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 20 15 1 0 1 24 1 0 3 25 1 0 3 26 1 0 4 27 1 0 5 28 1 0 5 29 1 0 6 30 1 0 6 31 1 0 7 32 1 0 7 33 1 0 8 34 1 6 9 35 1 0 9 36 1 0 12 37 1 0 13 38 1 6 14 39 1 0 14 40 1 0 16 41 1 0 17 42 1 0 18 43 1 0 19 44 1 0 20 45 1 0 23 46 1 0 M END