============================================================================== internuclear distances ------------------------------------------------------------------------------ center one | center two | atomic units | angstroms ------------------------------------------------------------------------------ 3 C | 1 C | 2.66292 | 1.40916 4 C | 2 C | 2.66292 | 1.40916 4 C | 3 C | 2.72431 | 1.44164 5 C | 2 C | 2.66292 | 1.40916 6 C | 1 C | 2.66292 | 1.40916 6 C | 5 C | 2.72431 | 1.44164 7 C | 3 C | 2.67215 | 1.41404 8 C | 4 C | 2.67215 | 1.41404 9 C | 5 C | 2.67215 | 1.41404 10 C | 6 C | 2.67215 | 1.41404 11 C | 7 C | 2.62803 | 1.39069 12 C | 8 C | 2.62803 | 1.39069 12 C | 11 C | 2.65468 | 1.40480 13 C | 9 C | 2.62803 | 1.39069 14 C | 10 C | 2.62803 | 1.39069 14 C | 13 C | 2.65468 | 1.40480 15 H | 1 C | 2.05004 | 1.08484 16 H | 2 C | 2.05004 | 1.08484 17 H | 7 C | 2.04741 | 1.08344 18 H | 8 C | 2.04741 | 1.08344 19 H | 9 C | 2.04741 | 1.08344 20 H | 10 C | 2.04741 | 1.08344 21 H | 11 C | 2.04484 | 1.08209 22 H | 12 C | 2.04484 | 1.08209 23 H | 13 C | 2.04484 | 1.08209 24 H | 14 C | 2.04484 | 1.08209 ------------------------------------------------------------------------------ number of included internuclear distances: 26 ============================================================================== internuclear angles ------------------------------------------------------------------------------ center 1 | center 2 | center 3 | degrees ------------------------------------------------------------------------------ 3 C | 1 C | 6 C | 121.87 3 C | 1 C | 15 H | 119.07 6 C | 1 C | 15 H | 119.07 4 C | 2 C | 5 C | 121.87 4 C | 2 C | 16 H | 119.07 5 C | 2 C | 16 H | 119.07 1 C | 3 C | 4 C | 119.07 1 C | 3 C | 7 C | 121.92 4 C | 3 C | 7 C | 119.02 2 C | 4 C | 3 C | 119.07 2 C | 4 C | 8 C | 121.92 3 C | 4 C | 8 C | 119.02 2 C | 5 C | 6 C | 119.07 2 C | 5 C | 9 C | 121.92 6 C | 5 C | 9 C | 119.02 1 C | 6 C | 5 C | 119.07 1 C | 6 C | 10 C | 121.92 5 C | 6 C | 10 C | 119.02 3 C | 7 C | 11 C | 120.56 3 C | 7 C | 17 H | 119.32 11 C | 7 C | 17 H | 120.13 4 C | 8 C | 12 C | 120.56 4 C | 8 C | 18 H | 119.32 12 C | 8 C | 18 H | 120.13 5 C | 9 C | 13 C | 120.56 5 C | 9 C | 19 H | 119.32 13 C | 9 C | 19 H | 120.13 6 C | 10 C | 14 C | 120.56 6 C | 10 C | 20 H | 119.32 14 C | 10 C | 20 H | 120.13 7 C | 11 C | 12 C | 120.43 7 C | 11 C | 21 H | 119.85 12 C | 11 C | 21 H | 119.72 8 C | 12 C | 11 C | 120.43 8 C | 12 C | 22 H | 119.85 11 C | 12 C | 22 H | 119.72 9 C | 13 C | 14 C | 120.43 9 C | 13 C | 23 H | 119.85 14 C | 13 C | 23 H | 119.72 10 C | 14 C | 13 C | 120.43 10 C | 14 C | 24 H | 119.85 13 C | 14 C | 24 H | 119.72 ------------------------------------------------------------------------------ number of included internuclear angles: 42 ==============================================================================