HMDB0030404 RDKit 3D Armillaripin 60 63 0 0 0 0 0 0 0 0999 V2000 8.3920 -1.0370 0.5278 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9100 -0.4436 -0.6688 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5340 -0.2694 -0.8477 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6194 -0.6489 0.0883 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2651 -0.4729 -0.0975 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3325 -0.9064 0.9565 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8189 0.1101 -1.2768 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3993 0.3010 -1.4845 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9029 0.8108 -2.4999 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5105 -0.1017 -0.5030 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1307 0.0784 -0.6932 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7118 -1.1203 -0.4055 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5006 -0.3167 0.5961 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4956 -1.0039 1.9387 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5414 0.7951 0.4556 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0983 2.0949 0.0169 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1498 3.0848 -0.4847 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5082 4.2200 -0.8831 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4043 2.3987 0.0579 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3236 1.3944 0.5619 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4504 1.3827 1.9453 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6963 1.4228 -0.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1934 0.0168 0.2418 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0644 0.0623 1.4685 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9461 -0.5492 -0.9407 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9584 -0.8372 0.4563 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8398 0.0345 0.0404 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7376 0.4959 -2.2268 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4052 1.0797 -3.4239 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0974 0.2970 -1.9929 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4874 -1.2220 0.4075 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2958 -0.3539 1.4036 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8258 -1.9602 0.7013 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9805 -1.1058 1.0113 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8135 -0.0277 1.3618 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6290 -1.6937 0.6731 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9317 -1.3074 1.8128 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1015 0.5574 -1.6759 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3157 -1.4990 -1.2622 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0957 -1.9316 0.0566 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8076 -0.3375 2.7658 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4385 -1.2922 2.1583 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0697 -1.9293 1.8856 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1168 0.9014 1.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8924 2.8397 -0.5165 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7137 3.3846 -0.2889 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9064 2.1096 2.3404 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3538 2.1879 0.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5966 1.5578 -1.1404 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5422 -0.4088 2.3261 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2846 1.1113 1.8006 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0670 -0.4045 1.3025 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3909 -0.4019 -1.8728 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9760 -0.1610 -0.9486 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0216 -1.6613 -0.7731 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9332 -1.0985 1.5323 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0185 -1.7828 -0.1566 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8204 0.1225 -1.0624 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5197 1.2886 -3.7456 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7877 0.6094 -2.7546 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 8 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 13 15 1 0 15 16 1 0 16 17 1 0 17 18 2 0 16 19 2 0 19 20 1 0 20 21 1 0 20 22 1 0 22 23 1 0 23 24 1 0 23 25 1 0 23 26 1 0 26 27 1 0 7 28 1 0 28 29 1 0 28 30 2 0 30 3 1 0 15 11 1 0 27 20 1 0 27 13 1 0 1 31 1 0 1 32 1 0 1 33 1 0 4 34 1 0 6 35 1 0 6 36 1 0 6 37 1 0 11 38 1 0 12 39 1 0 12 40 1 0 14 41 1 0 14 42 1 0 14 43 1 0 15 44 1 0 17 45 1 0 19 46 1 0 21 47 1 0 22 48 1 0 22 49 1 0 24 50 1 0 24 51 1 0 24 52 1 0 25 53 1 0 25 54 1 0 25 55 1 0 26 56 1 0 26 57 1 0 27 58 1 0 29 59 1 0 30 60 1 0 M END