1 51 Cycloheptadecane 2 1 C -1.294596 2.143559 0.790731 1 2 17 18 19 3 2 C -0.261087 3.192974 0.346689 1 1 3 20 21 4 3 C 1.169773 2.829430 0.782225 1 2 4 22 23 5 4 C 1.806102 1.774009 -0.138128 1 3 5 24 25 6 5 C 3.209059 1.327650 0.303117 1 4 6 26 27 7 6 C 3.269326 0.574714 1.643527 1 5 7 28 29 8 7 C 2.363302 -0.665356 1.754524 1 6 8 30 31 9 8 C 2.574119 -1.684128 0.623368 1 7 9 32 33 10 9 C 1.962762 -3.066515 0.905729 1 8 10 34 35 11 10 C 0.456544 -3.087016 1.214960 1 9 11 36 37 12 11 C -0.428965 -2.495186 0.105031 1 10 12 38 39 13 12 C -1.912427 -2.828929 0.339132 1 11 13 40 41 14 13 C -2.870293 -2.227345 -0.703865 1 12 14 42 43 15 14 C -2.973218 -0.691386 -0.706803 1 13 15 44 45 16 15 C -3.403238 -0.104853 0.647475 1 14 16 46 47 17 16 C -3.750131 1.393677 0.603616 1 15 17 48 49 18 17 C -2.640876 2.316947 0.071425 1 1 16 50 51 19 18 H -0.900976 1.124228 0.580915 5 1 20 19 H -1.441540 2.212766 1.894753 5 1 21 20 H -0.285412 3.318045 -0.761413 5 2 22 21 H -0.549383 4.178179 0.785937 5 2 23 22 H 1.146611 2.476315 1.838927 5 3 24 23 H 1.808247 3.744874 0.758633 5 3 25 24 H 1.145906 0.882855 -0.228415 5 4 26 25 H 1.878730 2.202312 -1.166771 5 4 27 26 H 3.870588 2.225208 0.359510 5 5 28 27 H 3.645036 0.677974 -0.492886 5 5 29 28 H 3.025550 1.276716 2.475708 5 6 30 29 H 4.325681 0.257006 1.817715 5 6 31 30 H 2.572328 -1.162620 2.731783 5 7 32 31 H 1.294856 -0.347918 1.787010 5 7 33 32 H 3.670589 -1.817745 0.461778 5 8 34 33 H 2.159679 -1.287915 -0.332515 5 8 35 34 H 2.155245 -3.727680 0.026561 5 9 36 35 H 2.507188 -3.526023 1.765750 5 9 37 36 H 0.256038 -2.552887 2.173658 5 10 38 37 H 0.160456 -4.150263 1.383065 5 10 39 38 H -0.115545 -2.902998 -0.884869 5 11 40 39 H -0.286764 -1.390508 0.073644 5 11 41 40 H -2.028281 -3.939368 0.316364 5 12 42 41 H -2.214823 -2.512224 1.363926 5 12 43 42 H -3.891536 -2.643105 -0.527076 5 13 44 43 H -2.561843 -2.575436 -1.718818 5 13 45 44 H -1.998547 -0.256514 -1.026288 5 14 46 45 H -3.719903 -0.388634 -1.479430 5 14 47 46 H -4.299966 -0.661562 1.011095 5 15 48 47 H -2.603118 -0.269450 1.405584 5 15 49 48 H -4.021635 1.723463 1.635454 5 16 50 49 H -4.664410 1.535160 -0.021592 5 16 51 50 H -2.976412 3.376331 0.178905 5 17 52 51 H -2.500519 2.140022 -1.021182 5 17 53