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0 0 12.6613 0.9749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 0.4749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7953 4.0488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0010 4.5488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5273 0.4749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6613 4.5488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 0.9749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1350 4.0488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3933 0.9749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5273 4.0488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 0.4749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2690 4.5488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2594 0.4749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.3933 4.5488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5369 0.9749 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4030 4.0488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9326 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7297 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8637 1.4499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0666 1.4499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5957 1.4499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7987 1.4499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2006 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9976 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6647 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4617 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1316 1.4499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3346 1.4499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9326 3.5739 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7297 3.5739 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8637 5.0238 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0666 5.0238 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3278 1.4499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5307 1.4499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5957 5.0238 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7987 5.0238 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4685 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2656 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2006 3.5739 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9976 3.5739 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6647 3.5739 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4617 3.5739 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1316 5.0238 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3346 5.0238 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3967 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1938 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3996 1.4499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6025 1.4499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3278 5.0238 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5307 5.0238 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4685 3.5739 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2656 3.5739 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0598 1.4499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2628 1.4499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7365 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5335 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3967 3.5739 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1938 3.5739 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3996 5.0238 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6025 5.0238 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1288 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9258 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0598 5.0238 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2628 5.0238 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6675 1.4499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8705 1.4499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7365 3.5739 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5335 3.5739 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7919 1.4499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9948 1.4499 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1288 3.5739 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9258 3.5739 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0044 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8015 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6675 5.0238 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8705 5.0238 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8608 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6579 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7919 5.0238 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9948 5.0238 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8469 1.5119 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 1.2850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2269 0.4380 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0930 4.5858 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8660 3.7388 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7130 3.5119 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.6623 0.6649 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.7963 4.3588 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 33 1 0 0 0 0 1107 1 0 0 0 0 2 34 1 0 0 0 0 2108 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 4 6 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 7 1 0 0 0 0 5 41 1 0 0 0 0 5 42 1 0 0 0 0 6 8 1 0 0 0 0 6 43 1 0 0 0 0 6 44 1 0 0 0 0 7 11 1 0 0 0 0 7 45 1 0 0 0 0 7 46 1 0 0 0 0 8 13 1 0 0 0 0 8 47 1 0 0 0 0 8 48 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 49 1 0 0 0 0 9 50 1 0 0 0 0 10 14 1 0 0 0 0 10 51 1 0 0 0 0 10 52 1 0 0 0 0 11 17 1 0 0 0 0 11 53 1 0 0 0 0 11 54 1 0 0 0 0 12 15 1 0 0 0 0 12 55 1 0 0 0 0 12 56 1 0 0 0 0 13 18 1 0 0 0 0 13 57 1 0 0 0 0 13 58 1 0 0 0 0 14 16 1 0 0 0 0 14 59 1 0 0 0 0 14 60 1 0 0 0 0 15 19 1 0 0 0 0 15 61 1 0 0 0 0 15 62 1 0 0 0 0 16 20 1 0 0 0 0 16 63 1 0 0 0 0 16 64 1 0 0 0 0 17 21 1 0 0 0 0 17 65 1 0 0 0 0 17 66 1 0 0 0 0 18 22 1 0 0 0 0 18 67 1 0 0 0 0 18 68 1 0 0 0 0 19 23 1 0 0 0 0 19 69 1 0 0 0 0 19 70 1 0 0 0 0 20 24 1 0 0 0 0 20 71 1 0 0 0 0 20 72 1 0 0 0 0 21 25 1 0 0 0 0 21 73 1 0 0 0 0 21 74 1 0 0 0 0 22 27 1 0 0 0 0 22 75 1 0 0 0 0 22 76 1 0 0 0 0 23 26 1 0 0 0 0 23 77 1 0 0 0 0 23 78 1 0 0 0 0 24 28 1 0 0 0 0 24 79 1 0 0 0 0 24 80 1 0 0 0 0 25 29 1 0 0 0 0 25 81 1 0 0 0 0 25 82 1 0 0 0 0 26 30 1 0 0 0 0 26 83 1 0 0 0 0 26 84 1 0 0 0 0 27 31 1 0 0 0 0 27 85 1 0 0 0 0 27 86 1 0 0 0 0 28 32 1 0 0 0 0 28 87 1 0 0 0 0 28 88 1 0 0 0 0 29 33 1 0 0 0 0 29 89 1 0 0 0 0 29 90 1 0 0 0 0 30 34 1 0 0 0 0 30 91 1 0 0 0 0 30 92 1 0 0 0 0 31 35 1 0 0 0 0 31 93 1 0 0 0 0 31 94 1 0 0 0 0 32 36 1 0 0 0 0 32 95 1 0 0 0 0 32 96 1 0 0 0 0 33 97 1 0 0 0 0 33 98 1 0 0 0 0 34 99 1 0 0 0 0 34100 1 0 0 0 0 35101 1 0 0 0 0 35102 1 0 0 0 0 35103 1 0 0 0 0 36104 1 0 0 0 0 36105 1 0 0 0 0 36106 1 0 0 0 0 M END > 62238 > 1 > 267 > 2 > 2 > 30 > AAADcfB8MAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAGgAACAAACACggAICAAAAAgAAAAAAAAAAAAAAAAAAAAAAAAAAEAIAAAAAQAAEAAAAAAGAwKAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA== > hexadecan-1-ol;octadecan-1-ol > 1-hexadecanol;1-octadecanol > hexadecan-1-ol;octadecan-1-ol > hexadecan-1-ol;octadecan-1-ol > hexadecan-1-ol;octadecan-1-ol > hexadecan-1-ol;octadecan-1-ol > InChI=1S/C18H38O.C16H34O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19;1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17/h19H,2-18H2,1H3;17H,2-16H2,1H3 > UBHWBODXJBSFLH-UHFFFAOYSA-N > 512.55323154 > C34H72O2 > 512.9 > CCCCCCCCCCCCCCCCCCO.CCCCCCCCCCCCCCCCO > CCCCCCCCCCCCCCCCCCO.CCCCCCCCCCCCCCCCO > 40.5 > 512.55323154 > 0 > 36 > 0 > 0 > 0 > 0 > 0 > 2 > -1 > 1 5 255 $$$$