HMDB0033685 RDKit 3D alpha-Tocopherol succinate 92 93 0 0 0 0 0 0 0 0999 V2000 -7.6036 -0.7295 0.8642 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1906 -0.4094 0.4944 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2830 -1.4507 0.2731 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7672 -2.8337 0.4168 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9755 -1.1971 -0.0692 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5520 0.1159 -0.1962 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4222 1.1340 0.0157 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0130 2.5348 -0.1088 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7624 0.8939 0.3661 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6513 1.9312 0.5824 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.4516 2.4976 -0.3833 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3767 2.0458 -1.5539 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.3911 3.6250 -0.0528 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7949 3.0366 0.0987 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.7776 4.0904 0.4258 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9759 3.7154 0.5722 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.4593 5.4290 0.5760 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1592 0.3228 -0.5564 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2131 -0.6547 0.0456 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6633 -2.0708 0.1422 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6727 -2.6387 1.5339 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9043 -2.9692 -0.7886 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5618 -3.0400 -0.6613 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1230 -3.5145 0.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6384 -3.5984 0.6451 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9967 -4.1097 2.0369 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2194 -2.2536 0.3905 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7471 -2.3541 0.4338 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2722 -0.9515 0.1635 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7621 -0.9057 0.1788 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4068 -1.7817 -0.8399 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2504 0.5421 0.0121 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7866 1.1193 -1.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2579 2.4896 -1.5431 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8497 3.5600 -0.5898 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4360 4.8795 -1.2054 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4330 3.4356 0.7879 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0396 -2.2092 -0.2988 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.6619 -1.5736 1.5896 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0382 0.2038 1.2947 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1476 -1.0108 -0.0566 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1599 -2.9523 1.4463 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6621 -2.9626 -0.2534 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0455 -3.5921 0.1173 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6391 2.9798 0.8361 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8818 3.1550 -0.4202 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2305 2.7103 -0.8807 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1281 4.0823 0.9183 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3931 4.3372 -0.8974 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.8149 2.3034 0.9294 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1146 2.5784 -0.8689 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5128 5.8582 1.4885 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9667 0.3590 -1.6471 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8601 1.3451 -0.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0450 -0.3115 1.1124 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2136 -0.5200 -0.4244 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7355 -2.6937 1.9391 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3423 -3.6898 1.4844 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1416 -2.0147 2.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1943 -2.6985 -1.8448 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3928 -3.9948 -0.6752 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9222 -3.7299 -1.4874 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0036 -2.0419 -0.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8476 -2.8322 1.4685 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7715 -4.5321 0.8972 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0378 -4.3133 -0.0944 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9776 -4.6267 2.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2090 -4.8366 2.3313 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9388 -3.2566 2.7124 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8357 -1.4942 1.1001 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9194 -1.9188 -0.6310 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0369 -3.0565 -0.3454 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1037 -2.7081 1.3986 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7982 -0.2719 0.8884 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8870 -0.6780 -0.8435 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1252 -1.2191 1.1808 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5176 -1.6623 -0.7298 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1515 -2.8390 -0.6674 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1644 -1.5295 -1.8796 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3328 0.5269 0.1369 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7301 1.0678 0.8473 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0841 0.4909 -2.1545 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6456 1.1296 -1.3052 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4092 2.4605 -1.5988 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9656 2.8033 -2.6017 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7737 3.6953 -0.5382 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7539 5.1357 -2.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4503 5.5911 -0.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4554 4.5919 -1.5214 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8170 4.4781 1.0603 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7142 3.1883 1.5815 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3011 2.7633 0.8154 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 3 4 1 0 3 5 1 0 5 6 2 0 6 7 1 0 7 8 1 0 7 9 2 0 9 10 1 0 10 11 1 0 11 12 2 0 11 13 1 0 13 14 1 0 14 15 1 0 15 16 2 0 15 17 1 0 6 18 1 0 18 19 1 0 19 20 1 0 20 21 1 0 20 22 1 0 22 23 1 0 23 24 1 0 24 25 1 0 25 26 1 0 25 27 1 0 27 28 1 0 28 29 1 0 29 30 1 0 30 31 1 0 30 32 1 0 32 33 1 0 33 34 1 0 34 35 1 0 35 36 1 0 35 37 1 0 20 38 1 0 9 2 1 0 38 5 1 0 1 39 1 0 1 40 1 0 1 41 1 0 4 42 1 0 4 43 1 0 4 44 1 0 8 45 1 0 8 46 1 0 8 47 1 0 13 48 1 0 13 49 1 0 14 50 1 0 14 51 1 0 17 52 1 0 18 53 1 0 18 54 1 0 19 55 1 0 19 56 1 0 21 57 1 0 21 58 1 0 21 59 1 0 22 60 1 0 22 61 1 0 23 62 1 0 23 63 1 0 24 64 1 0 24 65 1 0 25 66 1 0 26 67 1 0 26 68 1 0 26 69 1 0 27 70 1 0 27 71 1 0 28 72 1 0 28 73 1 0 29 74 1 0 29 75 1 0 30 76 1 0 31 77 1 0 31 78 1 0 31 79 1 0 32 80 1 0 32 81 1 0 33 82 1 0 33 83 1 0 34 84 1 0 34 85 1 0 35 86 1 0 36 87 1 0 36 88 1 0 36 89 1 0 37 90 1 0 37 91 1 0 37 92 1 0 M END