Symbolic Z-matrix: Charge = 0 Multiplicity = 1 Rh X 1 xxrh2 X 1 1. 2 90. C 3 cxx4 1 cxxrh4 2 dih4 0 C 3 cxx4 1 cxxrh5 2 dih5 0 C 4 cc6 1 ccrh6 2 dih6 0 H 4 hc7 1 hcrh7 2 dih7 0 C 5 cc8 4 ccc8 1 dih8 0 H 5 hc9 4 hcc9 1 dih9 0 C 2 1.47052 1 93.093 3 106.829 0 C 2 cxx11 1 cxxrh11 3 dih11 0 C 11 cc12 2 ccxx12 1 dih12 0 C 12 cc13 11 ccc13 2 dih13 0 C 2 cxx14 1 cxxrh14 3 dih14 0 C 2 cxx15 1 cxxrh15 3 dih15 0 C 6 cc16 4 ccc16 1 dih16 0 H 6 hc17 4 hcc17 1 dih17 0 H 6 hc18 4 hcc18 1 dih18 0 H 8 hc19 5 hcc19 4 dih19 0 H 8 hc20 5 hcc20 4 dih20 0 C 8 cc21 5 ccc21 4 dih21 0 B 10 bc22 2 bcxx22 1 dih22 0 H 11 hc23 15 hcc23 2 dih23 0 H 12 hc24 11 hcc24 2 dih24 0 H 13 hc25 12 hcc25 11 dih25 0 H 14 hc26 13 hcc26 2 dih26 0 H 15 hc27 11 hcc27 2 dih27 0 C 16 cc28 6 ccc28 4 dih28 0 H 16 hc29 6 hcc29 4 dih29 0 H 16 hc30 6 hcc30 4 dih30 0 H 21 hc31 8 hcc31 5 dih31 0 H 21 hc32 8 hcc32 5 dih32 0 C 21 cc33 8 ccc33 5 dih33 0 C 22 cb34 10 cbc34 2 dih34 0 C 22 cb35 10 cbc35 2 dih35 0 C 22 cb36 10 cbc36 2 dih36 0 H 28 hc37 16 hcc37 6 dih37 0 H 28 hc38 16 hcc38 6 dih38 0 H 33 hc39 21 hcc39 8 dih39 0 H 33 hc40 21 hcc40 8 dih40 0 C 34 cc41 22 ccb41 10 dih41 0 C 34 cc42 22 ccb42 10 dih42 0 C 35 cc43 22 ccb43 10 dih43 0 C 35 cc44 22 ccb44 10 dih44 0 C 36 cc45 22 ccb45 10 dih45 0 C 36 cc46 22 ccb46 10 dih46 0 H 41 hc47 34 hcc47 22 dih47 0 C 41 cc48 34 ccc48 22 dih48 0 C 42 cc49 34 ccc49 22 dih49 0 H 42 hc50 34 hcc50 22 dih50 0 H 43 hc51 35 hcc51 22 dih51 0 C 43 cc52 35 ccc52 22 dih52 0 C 44 cc53 35 ccc53 22 dih53 0 H 44 hc54 35 hcc54 22 dih54 0 H 45 hc55 36 hcc55 22 dih55 0 C 45 cc56 36 ccc56 22 dih56 0 C 46 cc57 36 ccc57 22 dih57 0 H 46 hc58 36 hcc58 22 dih58 0 H 48 hc59 41 hcc59 34 dih59 0 C 48 cc60 41 ccc60 34 dih60 0 H 49 hc61 42 hcc61 34 dih61 0 H 52 hc62 43 hcc62 35 dih62 0 C 52 cc63 43 ccc63 35 dih63 0 H 53 hc64 44 hcc64 35 dih64 0 H 56 hc65 45 hcc65 36 dih65 0 C 57 cc66 46 ccc66 36 dih66 0 H 57 hc67 46 hcc67 36 dih67 0 H 60 hc68 48 hcc68 41 dih68 0 H 63 hc69 52 hcc69 43 dih69 0 H 66 hc70 57 hcc70 46 dih70 0 X 1 xxrh71 2 xxrhxx71 3 dih71 0 X 71 1. 1 90. 2 dih72 0 C 71 cxx73 72 90. 1 dih73 0 C 71 cxx73 72 90. 73 180. 0 C 74 cc75 72 ccxx75 73 dih75 0 H 75 hc76 74 hcc76 73 dih76 0 H 75 hc77 74 hcc77 73 dih77 0 C 75 cc78 74 ccc78 73 dih78 0 H 78 hc79 75 hcc79 74 dih79 0 H 78 hc80 75 hcc80 74 dih80 0 C 78 cc81 75 ccc81 74 dih81 0 H 81 hc82 78 hcc82 75 dih82 0 H 81 hc83 78 hcc83 75 dih83 0 C 81 cc84 78 ccc84 75 dih84 0 H 84 hc85 81 hcc85 78 dih85 0 H 84 hc86 81 hcc86 78 dih86 0 C 84 cc87 81 ccc87 78 dih87 0 H 87 hc88 84 hcc88 81 dih88 0 H 87 hc89 84 hcc89 81 dih89 0 C 73 cc90 74 ccc90 75 dih90 0 H 90 hc91 73 hcc91 74 dih91 0 H 90 hc92 73 hcc92 74 dih92 0 H 74 hc93 73 hcc93 90 dih93 0 H 73 hc94 74 hcc94 75 dih94 0 Variables: xxrh2 2.04522 cxx4 1.74392 cxxrh4 99.35857 dih4 160.68324 cxxrh5 102.16655 dih5 -150.70184 cc6 1.50666 ccrh6 118.74215 dih6 16.30636 hc7 1.09058 hcrh7 106.15378 dih7 144.96166 cc8 1.51074 ccc8 124.53901 dih8 110.29257 hc9 1.08826 hcc9 117.56471 dih9 -98.41348 cxx11 1.56538 cxxrh11 78.76342 dih11 -3.23301 cc12 1.41236 ccxx12 59.17423 dih12 -90.58511 cc13 1.40071 ccc13 117.04371 dih13 7.29784 cxx14 1.21358 cxxrh14 90.16153 dih14 170.06316 cxx15 1.54463 cxxrh15 83.82742 dih15 51.56824 cc16 1.541 ccc16 111.12612 dih16 -176.54831 hc17 1.09647 hcc17 110.40237 dih17 62.78585 hc18 1.09421 hcc18 110.45397 dih18 -54.74898 hc19 1.09376 hcc19 111.86797 dih19 -38.37831 hc20 1.09512 hcc20 108.70516 dih20 -155.83333 cc21 1.54178 ccc21 112.51072 dih21 83.98344 bc22 1.65434 bcxx22 164.56711 dih22 -197.06881 hc23 1.08536 hcc23 119.34966 dih23 183.66056 hc24 1.08415 hcc24 121.25442 dih24 -176.35564 hc25 1.08482 hcc25 120.15432 dih25 175.32121 hc26 1.08551 hcc26 117.91432 dih26 184.68268 hc27 1.08581 hcc27 118.60582 dih27 177.1621 cc28 1.5343 ccc28 116.03254 dih28 49.03366 hc29 1.09808 hcc29 107.96979 dih29 172.12074 hc30 1.09829 hcc30 108.87694 dih30 -73.23666 hc31 1.09914 hcc31 109.39631 dih31 50.14629 hc32 1.09725 hcc32 107.0048 dih32 164.26668 cc33 1.53615 ccc33 116.94417 dih33 -74.42117 cb34 1.65574 cbc34 104.83967 dih34 22.53294 cb35 1.64552 cbc35 111.26705 dih35 -94.98085 cb36 1.64357 cbc36 109.02883 dih36 140.7342 hc37 1.09668 hcc37 106.80042 dih37 177.30869 hc38 1.09781 hcc38 109.57901 dih38 -69.08702 hc39 1.09963 hcc39 109.4213 dih39 -55.21191 hc40 1.09668 hcc40 106.72339 dih40 -168.56773 cc41 1.4052 ccb41 124.96564 dih41 25.44143 cc42 1.40928 ccb42 119.2791 dih42 -158.0235 cc43 1.41091 ccb43 120.97043 dih43 67.9726 cc44 1.40582 ccb44 123.51397 dih44 -113.3309 cc45 1.40531 ccb45 122.91677 dih45 -127.02509 cc46 1.40978 ccb46 121.49555 dih46 53.89732 hc47 1.0886 hcc47 119.81097 dih47 -3.04434 cc48 1.39672 ccc48 122.57483 dih48 -183.1127 cc49 1.39385 ccc49 122.46183 dih49 183.29925 hc50 1.08744 hcc50 118.78507 dih50 3.26685 hc51 1.08927 hcc51 118.91813 dih51 3.99111 cc52 1.39561 ccc52 122.72419 dih52 -178.58348 cc53 1.39713 ccc53 122.4824 dih53 179.42278 hc54 1.08705 hcc54 118.93122 dih54 -1.37167 hc55 1.08682 hcc55 118.89187 dih55 1.1604 cc56 1.39655 ccc56 122.43914 dih56 181.17486 cc57 1.39613 ccc57 122.73861 dih57 -181.34334 hc58 1.08956 hcc58 118.75359 dih58 -1.19249 hc59 1.08824 hcc59 119.79439 dih59 -180.29999 cc60 1.39224 ccc60 120.16839 dih60 -0.28258 hc61 1.08804 hcc61 119.73823 dih61 -180.29925 hc62 1.08827 hcc62 119.89462 dih62 180.02754 cc63 1.39462 ccc63 120.04054 dih63 -1.43658 hc64 1.08832 hcc64 119.69876 dih64 179.18948 hc65 1.08801 hcc65 119.67638 dih65 179.97816 cc66 1.39495 ccc66 119.96737 dih66 0.39325 hc67 1.08869 hcc67 120.0177 dih67 180.89173 hc68 1.0873 hcc68 120.56327 dih68 179.94999 hc69 1.08735 hcc69 120.53562 dih69 -179.17498 hc70 1.08733 hcc70 120.50689 dih70 -179.95329 xxrh71 2.05849 xxrhxx71 129.51056 dih71 171.77628 dih72 16.3271 cxx73 0.70543 dih73 90.06997 cc75 1.50677 ccxx75 72.25979 dih75 163.60414 hc76 1.09281 hcc76 111.72181 dih76 40.06416 hc77 1.09433 hcc77 108.48816 dih77 155.39899 cc78 1.53971 ccc78 113.75926 dih78 -84.18505 hc79 1.09996 hcc79 109.62229 dih79 -51.42712 hc80 1.09614 hcc80 106.53327 dih80 -166.06036 cc81 1.53464 ccc81 116.74891 dih81 73.14885 hc82 1.09873 hcc82 109.20179 dih82 55.8082 hc83 1.09679 hcc83 106.88169 dih83 169.22672 cc84 1.54183 ccc84 116.16049 dih84 -69.67185 hc85 1.09689 hcc85 109.18099 dih85 -138.2466 hc86 1.09804 hcc86 109.13804 dih86 -23.66452 cc87 1.53397 ccc87 116.35085 dih87 100.95157 hc88 1.09803 hcc88 109.23938 dih88 67.41566 hc89 1.0985 hcc89 108.4061 dih89 182.52791 cc90 1.50688 ccc90 122.27611 dih90 4.15757 hc91 1.09552 hcc91 110.93873 dih91 -151.18576 hc92 1.09348 hcc92 110.70202 dih92 -32.31385 hc93 1.09034 hcc93 115.87795 dih93 -147.21762 hc94 1.08925 hcc94 117.56352 dih94 152.20108