HMDB0015401 RDKit 3D Nelarabine 36 38 0 0 0 0 0 0 0 0999 V2000 5.8016 0.8818 0.2368 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4831 1.3635 0.2216 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4128 0.5063 0.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5723 -0.7932 0.6652 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5107 -1.5941 0.8698 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7545 -2.9699 1.1073 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2517 -1.1185 0.8525 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0274 0.1779 0.6285 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1178 1.0041 0.4176 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6483 2.2419 0.2178 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3061 2.1978 0.2999 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0761 0.9235 0.5533 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.4361 0.5189 0.7021 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.6764 -0.7857 0.2897 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0113 -0.8835 -0.0399 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.1426 -1.7166 -1.3025 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4916 -1.8349 -1.6646 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5453 0.4932 -0.2679 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.2741 0.8751 0.8570 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2738 1.3143 -0.2807 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.6491 1.3061 -1.5079 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0819 0.6532 -0.8243 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5212 1.6133 0.6473 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9226 -0.0638 0.8044 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3767 -3.7210 0.4916 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3283 -3.2572 1.9197 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3632 3.0626 0.1791 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8412 0.7338 1.7122 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5778 -1.4150 0.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5424 -1.3091 -2.1282 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7831 -2.7412 -1.0553 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0701 -1.2059 -1.1665 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1248 0.6014 -1.2016 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0111 1.7735 1.1463 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4458 2.3527 0.0682 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7809 0.8145 -1.4937 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 1 0 5 7 2 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 1 0 16 17 1 0 15 18 1 0 18 19 1 0 18 20 1 0 20 21 1 0 9 3 1 0 20 13 1 0 12 8 1 0 1 22 1 0 1 23 1 0 1 24 1 0 6 25 1 0 6 26 1 0 11 27 1 0 13 28 1 1 15 29 1 1 16 30 1 0 16 31 1 0 17 32 1 0 18 33 1 6 19 34 1 0 20 35 1 1 21 36 1 0 M END