HMDB0002310 RDKit 3D S-Methylmalonyl-CoA 95 97 0 0 0 0 0 0 0 0999 V2000 7.8846 -0.9679 1.7745 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9583 -0.7179 0.7115 C 0 0 1 0 0 0 0 0 0 0 0 0 9.7676 0.4309 1.2406 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9718 0.2863 1.4802 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1471 1.6532 1.4570 O 0 0 0 0 0 0 0 0 0 0 0 0 9.8606 -1.8595 0.5901 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6045 -2.8298 1.3529 O 0 0 0 0 0 0 0 0 0 0 0 0 11.2151 -2.0233 -0.4662 S 0 0 0 0 0 0 0 0 0 0 0 0 11.3599 -1.1181 -1.9547 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5558 -1.6568 -3.0898 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1540 -1.5892 -2.9218 N 0 0 0 0 0 0 0 0 0 0 0 0 8.4517 -0.3420 -2.8517 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1228 0.7080 -2.9437 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9830 -0.3900 -2.6759 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3721 0.9864 -2.6244 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9346 0.9128 -2.4312 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4052 0.3069 -1.2608 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1663 -0.1556 -0.3950 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9528 0.2152 -1.0547 C 0 0 2 0 0 0 0 0 0 0 0 0 2.2259 0.7856 -2.1113 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5083 0.7447 0.2834 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2057 -0.0704 1.3596 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7598 2.2196 0.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0281 0.4775 0.4433 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5254 0.9380 1.6500 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1153 0.6216 1.8196 P 0 0 0 0 0 5 0 0 0 0 0 0 -1.9269 1.8715 1.9401 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3174 -0.3848 3.1849 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6314 -0.2226 0.4648 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8017 -1.3830 0.8208 P 0 0 0 0 0 5 0 0 0 0 0 0 -3.1906 -2.0428 -0.4891 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1899 -2.5590 1.8820 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1990 -0.7502 1.4921 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8254 0.0605 0.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1040 0.6633 1.0989 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9600 -0.3423 1.4482 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.0360 -0.3809 0.6017 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.1979 -0.8279 1.3900 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.3133 -0.8386 2.7176 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.5238 -1.3147 3.0360 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.2063 -1.6179 1.9296 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.4579 -2.1268 1.6511 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.3428 -2.4514 2.6920 N 0 0 0 0 0 0 0 0 0 0 0 0 -12.8141 -2.3039 0.3799 N 0 0 0 0 0 0 0 0 0 0 0 0 -11.9737 -1.9942 -0.6316 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7539 -1.4991 -0.3918 N 0 0 0 0 0 0 0 0 0 0 0 0 -10.3516 -1.3034 0.8908 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2043 1.0531 0.1921 C 0 0 2 0 0 0 0 0 0 0 0 0 -9.0045 1.2464 -0.8880 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.7971 1.5201 0.0582 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.1894 1.2887 -1.1337 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4397 2.5603 -1.8764 P 0 0 0 0 0 5 0 0 0 0 0 0 -3.9991 2.1565 -2.1411 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0919 2.9228 -3.4102 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3495 3.9587 -0.9118 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3061 -0.0425 1.8836 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2109 -1.7921 1.4765 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3630 -1.2130 2.7459 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4389 -0.4182 -0.1869 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5605 2.3348 2.0811 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0466 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33 34 1 0 34 35 1 0 35 36 1 0 36 37 1 0 37 38 1 0 38 39 1 0 39 40 2 0 40 41 1 0 41 42 2 0 42 43 1 0 42 44 1 0 44 45 2 0 45 46 1 0 46 47 2 0 37 48 1 0 48 49 1 0 48 50 1 0 50 51 1 0 51 52 1 0 52 53 2 0 52 54 1 0 52 55 1 0 50 35 1 0 47 38 1 0 47 41 1 0 1 56 1 0 1 57 1 0 1 58 1 0 2 59 1 6 5 60 1 0 9 61 1 0 9 62 1 0 10 63 1 0 10 64 1 0 11 65 1 0 14 66 1 0 14 67 1 0 15 68 1 0 15 69 1 0 16 70 1 0 19 71 1 1 20 72 1 0 22 73 1 0 22 74 1 0 22 75 1 0 23 76 1 0 23 77 1 0 23 78 1 0 24 79 1 0 24 80 1 0 28 81 1 0 32 82 1 0 34 83 1 0 34 84 1 0 35 85 1 0 37 86 1 0 39 87 1 0 43 88 1 0 43 89 1 0 45 90 1 0 48 91 1 1 49 92 1 0 50 93 1 1 54 94 1 0 55 95 1 0 M END