KEGG:C01011 (3S)-Citramalyl-CoA ISISHOST03240423032D 1 1.00000 0.00000 958 57 59 0 1 0 999 V2000 0.0586 2.1069 0.0000 N 0 0 3 0 0 0 0 0 0 -0.7517 1.5586 0.0000 C 0 0 1 0 0 0 0 0 0 1.2793 2.1069 0.0000 C 0 0 0 0 0 0 0 0 0 0.0586 2.8138 0.0000 C 0 0 0 0 0 0 0 0 0 -0.9621 0.9034 0.0000 C 0 0 1 0 0 0 0 0 0 -1.3276 1.9759 0.0000 O 0 0 0 0 0 0 0 0 0 1.2793 2.8138 0.0000 C 0 0 0 0 0 0 0 0 0 1.8862 1.7517 0.0000 N 0 0 0 0 0 0 0 0 0 0.6690 3.1690 0.0000 N 0 0 0 0 0 0 0 0 0 -1.6759 0.9034 0.0000 C 0 0 1 0 0 0 0 0 0 -0.5517 0.3379 0.0000 O 0 0 0 0 0 0 0 0 0 -1.8966 1.5690 0.0000 C 0 0 1 0 0 0 0 0 0 1.8862 3.1621 0.0000 C 0 0 0 0 0 0 0 0 0 2.4966 2.1069 0.0000 C 0 0 0 0 0 0 0 0 0 -2.0828 0.3379 0.0000 O 0 0 0 0 0 0 0 0 0 -2.5517 1.7724 0.0000 C 0 0 0 0 0 0 0 0 0 2.4966 2.8138 0.0000 N 0 0 0 0 0 0 0 0 0 1.8828 3.8586 0.0000 N 0 0 0 0 0 0 0 0 0 -2.7759 0.4069 0.0000 P 0 0 3 0 0 0 0 0 0 -3.5034 1.3207 0.0000 O 0 0 0 0 0 0 0 0 0 -2.7207 1.0690 0.0000 O 0 0 0 0 0 0 0 0 0 -3.4586 0.3897 0.0000 O 0 0 0 0 0 0 0 0 0 -2.7793 -0.2931 0.0000 O 0 0 0 0 0 0 0 0 0 -4.6172 1.3103 0.0000 P 0 0 3 0 0 0 0 0 0 -4.6241 -0.2103 0.0000 O 0 0 0 0 0 0 0 0 0 -4.6138 2.1310 0.0000 O 0 0 0 0 0 0 0 0 0 -5.3207 1.3207 0.0000 O 0 0 0 0 0 0 0 0 0 -4.6207 -1.5897 0.0000 P 0 0 3 0 0 0 0 0 0 -3.8966 -1.5759 0.0000 O 0 0 0 0 0 0 0 0 0 -4.6138 -2.2759 0.0000 O 0 0 0 0 0 0 0 0 0 -5.3241 -1.5793 0.0000 O 0 0 0 0 0 0 0 0 0 -3.2931 -1.2276 0.0000 C 0 0 0 0 0 0 0 0 0 -2.6897 -1.5759 0.0000 C 0 0 3 0 0 0 0 0 0 -2.0862 -1.2276 0.0000 C 0 0 3 0 0 0 0 0 0 -2.6897 -2.2759 0.0000 C 0 0 0 0 0 0 0 0 0 -2.6966 -0.8069 0.0000 C 0 0 0 0 0 0 0 0 0 -1.4793 -1.5759 0.0000 C 0 0 0 0 0 0 0 0 0 -2.0862 -0.5310 0.0000 O 0 0 0 0 0 0 0 0 0 -0.3897 -1.2690 0.0000 N 0 0 0 0 0 0 0 0 0 -1.4793 -2.2759 0.0000 O 0 0 0 0 0 0 0 0 0 0.2172 -1.6207 0.0000 C 0 0 0 0 0 0 0 0 0 0.8207 -1.2690 0.0000 C 0 0 0 0 0 0 0 0 0 1.4241 -1.6207 0.0000 C 0 0 0 0 0 0 0 0 0 2.2828 -1.2690 0.0000 N 0 0 0 0 0 0 0 0 0 1.4241 -2.3172 0.0000 O 0 0 0 0 0 0 0 0 0 2.8862 -1.6207 0.0000 C 0 0 0 0 0 0 0 0 0 3.4897 -1.2690 0.0000 C 0 0 0 0 0 0 0 0 0 4.0931 -1.6207 0.0000 S 0 0 0 0 0 0 0 0 0 4.7000 -1.2690 0.0000 C 0 0 0 0 0 0 0 0 0 5.3035 -1.6172 0.0000 C 0 0 0 0 0 0 0 0 0 4.7000 -0.5724 0.0000 O 0 0 0 0 0 0 0 0 0 5.9069 -1.2690 0.0000 C 0 0 2 0 0 0 0 0 0 6.6069 -1.2690 0.0000 C 0 0 0 0 0 0 0 0 0 5.9069 -0.5724 0.0000 C 0 0 0 0 0 0 0 0 0 5.9069 -1.9966 0.0000 O 0 0 0 0 0 0 0 0 0 6.9517 -0.6655 0.0000 O 0 0 0 0 0 0 0 0 0 6.9517 -1.8759 0.0000 O 0 0 0 0 0 0 0 0 0 2 1 1 1 0 0 1 3 1 0 0 0 1 4 1 0 0 0 2 5 1 0 0 0 2 6 1 0 0 0 3 7 2 0 0 0 3 8 1 0 0 0 4 9 2 0 0 0 5 10 1 0 0 0 5 11 1 6 0 0 6 12 1 0 0 0 7 13 1 0 0 0 8 14 2 0 0 0 10 15 1 6 0 0 12 16 1 1 0 0 13 17 2 0 0 0 13 18 1 0 0 0 15 19 1 0 0 0 16 20 1 0 0 0 19 21 1 0 0 0 19 22 1 0 0 0 19 23 2 0 0 0 20 24 1 0 0 0 24 25 1 0 0 0 24 26 1 0 0 0 24 27 2 0 0 0 25 28 1 0 0 0 28 29 1 0 0 0 28 30 1 0 0 0 28 31 2 0 0 0 29 32 1 0 0 0 32 33 1 0 0 0 33 34 1 0 0 0 33 35 1 0 0 0 33 36 1 0 0 0 34 37 1 0 0 0 34 38 1 0 0 0 37 39 1 0 0 0 37 40 2 0 0 0 39 41 1 0 0 0 41 42 1 0 0 0 42 43 1 0 0 0 43 44 1 0 0 0 43 45 2 0 0 0 44 46 1 0 0 0 46 47 1 0 0 0 47 48 1 0 0 0 48 49 1 0 0 0 49 50 1 0 0 0 49 51 2 0 0 0 52 50 1 1 0 0 52 53 1 0 0 0 52 54 1 6 0 0 52 55 1 0 0 0 53 56 1 0 0 0 53 57 2 0 0 0 7 9 1 0 0 0 10 12 1 0 0 0 14 17 1 0 0 0 M END