ChEBI 71 71 0 0 1 0 0 0 0 0 1 V2000 5.7423 -3.9600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7423 -5.2900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5904 -3.2950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5904 -5.9550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4386 -3.9600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4386 -5.2900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8941 -3.2950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8941 -5.9550 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5903 -7.2850 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2868 -5.9550 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2868 -3.2950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1350 -3.9600 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0932 -3.2887 0.0000 P 0 0 0 0 0 0 0 0 0 0 0 0 8.0932 -2.1360 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0932 -4.2767 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2078 -3.2887 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3634 -3.9471 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5114 -3.2755 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6670 -3.9339 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8150 -3.2624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9706 -3.9208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1186 -3.2492 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2742 -3.9076 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 18.4222 -3.2361 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 19.5778 -3.8945 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 20.7258 -3.2229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.8814 -3.8813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 23.0294 -3.2097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 24.1850 -3.8682 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 25.3330 -3.1966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.4886 -3.8550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 27.6366 -3.1834 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 28.7922 -3.8418 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 29.9402 -3.1703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 31.0957 -3.8287 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 32.2437 -3.1571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 33.3993 -3.8155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 34.5473 -3.1440 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 35.7029 -3.8024 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 36.8509 -3.1308 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 38.0065 -3.7892 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 39.1545 -3.1177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 40.3101 -3.7761 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 41.4581 -3.1045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 42.6137 -3.7629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 43.7617 -3.0913 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 44.9173 -3.7498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 46.0653 -3.0782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 47.2209 -3.7366 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 48.3689 -3.0650 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 49.5245 -3.7234 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 50.6725 -3.0519 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 51.8281 -3.7103 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 52.9761 -3.0387 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 54.1317 -3.6971 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 55.2796 -3.0256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 56.4352 -3.6840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 57.5832 -3.0124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 58.7388 -3.6708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 59.8868 -2.9993 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6746 -5.2639 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 17.2818 -5.2376 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 21.8890 -5.2113 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 26.4962 -5.1850 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 31.1033 -5.1587 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 35.7105 -5.1324 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 40.3177 -5.1060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 44.9249 -5.0797 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 49.5321 -5.0534 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 54.1392 -5.0271 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 58.7464 -5.0008 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 2 4 1 0 0 0 0 3 5 1 0 0 0 0 4 6 1 0 0 0 0 5 6 1 0 0 0 0 1 7 1 0 0 0 0 2 8 1 1 0 0 0 4 9 1 1 0 0 0 6 10 1 6 0 0 0 5 11 1 1 0 0 0 12 11 1 0 0 0 0 13 7 1 0 0 0 0 14 13 2 0 0 0 0 15 13 1 0 0 0 0 16 13 1 0 0 0 0 17 16 1 0 0 0 0 18 17 1 0 0 0 0 19 18 2 0 0 0 0 20 19 1 0 0 0 0 21 20 1 0 0 0 0 22 21 1 0 0 0 0 23 22 2 0 0 0 0 24 23 1 0 0 0 0 25 24 1 0 0 0 0 26 25 1 0 0 0 0 27 26 2 0 0 0 0 28 27 1 0 0 0 0 29 28 1 0 0 0 0 30 29 1 0 0 0 0 31 30 2 0 0 0 0 32 31 1 0 0 0 0 33 32 1 0 0 0 0 34 33 1 0 0 0 0 35 34 2 0 0 0 0 36 35 1 0 0 0 0 37 36 1 0 0 0 0 38 37 1 0 0 0 0 39 38 2 0 0 0 0 40 39 1 0 0 0 0 41 40 1 0 0 0 0 42 41 1 0 0 0 0 43 42 2 0 0 0 0 44 43 1 0 0 0 0 45 44 1 0 0 0 0 46 45 1 0 0 0 0 47 46 2 0 0 0 0 48 47 1 0 0 0 0 49 48 1 0 0 0 0 50 49 1 0 0 0 0 51 50 2 0 0 0 0 52 51 1 0 0 0 0 53 52 1 0 0 0 0 54 53 1 0 0 0 0 55 54 2 0 0 0 0 56 55 1 0 0 0 0 57 56 1 0 0 0 0 58 57 1 0 0 0 0 59 58 2 0 0 0 0 60 59 1 0 0 0 0 61 19 1 0 0 0 0 62 23 1 0 0 0 0 63 27 1 0 0 0 0 64 31 1 0 0 0 0 65 35 1 0 0 0 0 66 39 1 0 0 0 0 67 43 1 0 0 0 0 68 47 1 0 0 0 0 69 51 1 0 0 0 0 70 55 1 0 0 0 0 71 59 1 0 0 0 0 M END