HMDB0256203 RDKit 3D Pegorgotein 25 24 0 0 0 0 0 0 0 0999 V2000 -4.3159 -1.1131 0.2579 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9987 0.1365 0.7031 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6930 0.5124 0.6042 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1867 0.5050 -0.8036 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8580 0.8836 -0.9438 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2306 0.2485 -0.3654 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0571 -0.7551 0.3409 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6264 0.7125 -0.5612 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6143 -0.1543 0.1766 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9804 0.3625 -0.0609 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1030 -0.2753 0.5230 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1484 1.3722 -0.7841 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1162 -1.3311 -0.7889 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4317 -1.2306 0.3924 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8788 -1.9353 0.8702 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6086 1.5569 0.9816 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0938 -0.1175 1.2919 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8028 1.2282 -1.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2999 -0.5263 -1.2284 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7093 1.7379 -0.2005 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9234 0.6647 -1.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5278 -1.2135 -0.1764 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3700 -0.1933 1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0644 -0.2696 0.0973 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0432 -0.8059 1.4389 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 5 6 1 0 6 7 2 0 6 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 10 12 2 0 1 13 1 0 1 14 1 0 1 15 1 0 3 16 1 0 3 17 1 0 4 18 1 0 4 19 1 0 8 20 1 0 8 21 1 0 9 22 1 0 9 23 1 0 11 24 1 0 11 25 1 0 M END