IHI
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C01 | N02 | doub | 1.32Å | 1.28Å | Aromatic |
| C01 | N05 | sing | 1.37Å | 1.42Å | Aromatic |
| C01 | H01 | sing | 1.08Å | 1.08Å | |
| N02 | C03 | sing | 1.37Å | 1.39Å | Aromatic |
| C03 | C04 | doub | 1.39Å | 1.34Å | Aromatic |
| C03 | C07 | sing | 1.39Å | 1.36Å | Aromatic |
| C04 | N05 | sing | 1.36Å | 1.44Å | Aromatic |
| C04 | N08 | sing | 1.34Å | 1.40Å | Aromatic |
| N05 | C12 | sing | 1.46Å | 1.48Å | |
| C07 | N09 | doub | 1.35Å | 1.37Å | Aromatic |
| C07 | N11 | sing | 1.41Å | 1.40Å | |
| N08 | C10 | doub | 1.35Å | 1.36Å | Aromatic |
| N09 | C10 | sing | 1.36Å | 1.35Å | Aromatic |
| C10 | C26 | sing | 1.42Å | 1.50Å | |
| N11 | C32 | sing | 1.41Å | 1.40Å | |
| N11 | H11 | sing | 1.02Å | 1.00Å | |
| C12 | C13 | sing | 1.54Å | 1.52Å | |
| C12 | C16 | sing | 1.54Å | 1.54Å | |
| C12 | H12 | sing | 1.10Å | 1.10Å | |
| C13 | C14 | sing | 1.52Å | 1.50Å | |
| C13 | H131 | sing | 1.10Å | 1.10Å | |
| C13 | H132 | sing | 1.09Å | 1.10Å | |
| C14 | C15 | sing | 1.52Å | 1.53Å | |
| C14 | H141 | sing | 1.09Å | 1.10Å | |
| C14 | H142 | sing | 1.10Å | 1.10Å | |
| C15 | C16 | sing | 1.52Å | 1.52Å | |
| C15 | H151 | sing | 1.09Å | 1.10Å | |
| C15 | H152 | sing | 1.10Å | 1.10Å | |
| C16 | H161 | sing | 1.10Å | 1.10Å | |
| C16 | H162 | sing | 1.09Å | 1.10Å | |
| N27 | C26 | trip | 1.17Å | 1.44Å | |
| C32 | C33 | doub | 1.40Å | 1.45Å | Aromatic |
| C32 | C37 | sing | 1.39Å | 1.44Å | Aromatic |
| C33 | C34 | sing | 1.39Å | 1.43Å | Aromatic |
| C33 | H33 | sing | 1.09Å | 1.08Å | |
| C34 | C35 | doub | 1.39Å | 1.43Å | Aromatic |
| C34 | H34 | sing | 1.09Å | 1.08Å | |
| C35 | C36 | sing | 1.39Å | 1.41Å | Aromatic |
| C35 | H35 | sing | 1.09Å | 1.08Å | |
| C36 | C37 | doub | 1.39Å | 1.44Å | Aromatic |
| C36 | H36 | sing | 1.09Å | 1.08Å | |
| C37 | O38 | sing | 1.36Å | 1.45Å | |
| O38 | C39 | sing | 1.43Å | 1.41Å | |
| C39 | C40 | sing | 1.52Å | 60.07Å | |
| C39 | H391 | sing | 1.09Å | 1.10Å | |
| C39 | H392 | sing | 1.09Å | 1.10Å | |
| C40 | C41 | sing | 1.53Å | 0.00Å | |
| C40 | H401 | sing | 1.10Å | 0.00Å | |
| C40 | H402 | sing | 1.10Å | 0.00Å | |
| C41 | N51 | sing | 1.46Å | 0.00Å | |
| C41 | H411 | sing | 1.10Å | 0.00Å | |
| C41 | H412 | sing | 1.10Å | 0.00Å | |
| N51 | C52 | sing | 1.36Å | 0.00Å | Aromatic |
| N51 | C55 | sing | 1.36Å | 0.00Å | Aromatic |
| C52 | N53 | doub | 1.31Å | 0.00Å | Aromatic |
| C52 | H52 | sing | 1.08Å | 0.00Å | |
| N53 | C54 | sing | 1.37Å | 0.00Å | Aromatic |
| C54 | C55 | doub | 1.37Å | 0.00Å | Aromatic |
| C54 | H54 | sing | 1.08Å | 0.00Å | |
| C55 | H55 | sing | 1.08Å | 0.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| N02 | C01 | N05 | 113.9° | 112.1° |
| N02 | C01 | H01 | 123.0° | 125.6° |
| C01 | N02 | C03 | 104.9° | 104.9° |
| N05 | C01 | H01 | 123.0° | 122.3° |
| C01 | N05 | C04 | 102.9° | 107.2° |
| C01 | N05 | C12 | 126.7° | 126.0° |
| N02 | C03 | C04 | 112.5° | 110.7° |
| N02 | C03 | C07 | 129.1° | 132.4° |
| C04 | C03 | C07 | 118.4° | 116.9° |
| C03 | C04 | N05 | 105.4° | 105.2° |
| C03 | C04 | N08 | 123.1° | 127.2° |
| C03 | C07 | N09 | 120.3° | 119.1° |
| C03 | C07 | N11 | 115.1° | 120.7° |
| N05 | C04 | N08 | 131.4° | 127.6° |
| C04 | N05 | C12 | 129.3° | 126.9° |
| C04 | N08 | C10 | 115.9° | 110.5° |
| N05 | C12 | C13 | 115.7° | 113.3° |
| N05 | C12 | C16 | 113.1° | 114.4° |
| N05 | C12 | H12 | 101.5° | 104.1° |
| N09 | C07 | N11 | 124.6° | 120.2° |
| C07 | N09 | C10 | 120.3° | 117.5° |
| C07 | N11 | C32 | 123.6° | 132.8° |
| C07 | N11 | H11 | 118.2° | 113.9° |
| N08 | C10 | N09 | 121.9° | 128.9° |
| N08 | C10 | C26 | 121.1° | 115.6° |
| N09 | C10 | C26 | 116.9° | 115.5° |
| C10 | C26 | N27 | 111.0° | 179.9° |
| C32 | N11 | H11 | 118.2° | 113.4° |
| N11 | C32 | C33 | 124.2° | 119.4° |
| N11 | C32 | C37 | 116.7° | 120.6° |
| C13 | C12 | C16 | 107.1° | 106.1° |
| C13 | C12 | H12 | 108.2° | 109.8° |
| C12 | C13 | C14 | 100.9° | 104.6° |
| C12 | C13 | H131 | 112.4° | 110.8° |
| C12 | C13 | H132 | 114.2° | 112.0° |
| C16 | C12 | H12 | 111.1° | 109.0° |
| C12 | C16 | C15 | 103.6° | 105.5° |
| C12 | C16 | H161 | 111.5° | 109.3° |
| C12 | C16 | H162 | 112.7° | 113.4° |
| C14 | C13 | H131 | 112.4° | 109.9° |
| C14 | C13 | H132 | 114.2° | 111.9° |
| C13 | C14 | C15 | 101.5° | 103.3° |
| C13 | C14 | H141 | 112.2° | 112.3° |
| C13 | C14 | H142 | 113.9° | 110.2° |
| H131 | C13 | H132 | 103.1° | 107.6° |
| C15 | C14 | H141 | 112.2° | 112.3° |
| C15 | C14 | H142 | 113.9° | 110.4° |
| C14 | C15 | C16 | 102.0° | 103.8° |
| C14 | C15 | H151 | 112.0° | 112.5° |
| C14 | C15 | H152 | 113.6° | 110.2° |
| H141 | C14 | H142 | 103.5° | 108.4° |
| C16 | C15 | H151 | 112.0° | 112.2° |
| C16 | C15 | H152 | 113.6° | 110.0° |
| C15 | C16 | H161 | 111.5° | 109.4° |
| C15 | C16 | H162 | 112.7° | 111.5° |
| H151 | C15 | H152 | 103.9° | 108.2° |
| H161 | C16 | H162 | 105.1° | 107.7° |
| C33 | C32 | C37 | 119.1° | 119.9° |
| C32 | C33 | C34 | 119.4° | 120.0° |
| C32 | C33 | H33 | 120.3° | 120.6° |
| C32 | C37 | C36 | 120.6° | 120.0° |
| C32 | C37 | O38 | 122.0° | 120.9° |
| C34 | C33 | H33 | 120.3° | 119.3° |
| C33 | C34 | C35 | 121.0° | 120.0° |
| C33 | C34 | H34 | 119.5° | 120.0° |
| C35 | C34 | H34 | 119.5° | 120.0° |
| C34 | C35 | C36 | 120.0° | 120.0° |
| C34 | C35 | H35 | 120.0° | 120.0° |
| C36 | C35 | H35 | 120.0° | 120.0° |
| C35 | C36 | C37 | 119.9° | 120.0° |
| C35 | C36 | H36 | 120.1° | 119.7° |
| C37 | C36 | H36 | 120.0° | 120.3° |
| C36 | C37 | O38 | 117.4° | 119.1° |
| C37 | O38 | C39 | 121.4° | 117.0° |
| O38 | C39 | C40 | 60.3° | 108.7° |
| O38 | C39 | H391 | 130.7° | 108.1° |
| O38 | C39 | H392 | 135.8° | 108.5° |
| C40 | C39 | H391 | 130.7° | 111.3° |
| C40 | C39 | H392 | 135.8° | 110.9° |
| C39 | C40 | C41 | 90.0° | 113.4° |
| C39 | C40 | H401 | 90.0° | 108.7° |
| C39 | C40 | H402 | 90.0° | 109.3° |
| H391 | C39 | H392 | 75.0° | 109.2° |
| C41 | C40 | H401 | 90.0° | 108.9° |
| C41 | C40 | H402 | 90.0° | 110.8° |
| C40 | C41 | N51 | 90.0° | 113.8° |
| C40 | C41 | H411 | 90.0° | 110.8° |
| C40 | C41 | H412 | 90.0° | 110.0° |
| H401 | C40 | H402 | 90.0° | 105.5° |
| N51 | C41 | H411 | 90.0° | 108.4° |
| N51 | C41 | H412 | 90.0° | 106.7° |
| C41 | N51 | C52 | 90.0° | 125.7° |
| C41 | N51 | C55 | 90.0° | 125.8° |
| H411 | C41 | H412 | 90.0° | 106.8° |
| C52 | N51 | C55 | 90.0° | 108.5° |
| N51 | C52 | N53 | 90.0° | 111.3° |
| N51 | C52 | H52 | 90.0° | 123.0° |
| N51 | C55 | C54 | 90.0° | 104.3° |
| N51 | C55 | H55 | 90.0° | 123.1° |
| N53 | C52 | H52 | 90.0° | 125.7° |
| C52 | N53 | C54 | 90.0° | 104.7° |
| N53 | C54 | C55 | 90.0° | 111.2° |
| N53 | C54 | H54 | 90.0° | 121.3° |
| C55 | C54 | H54 | 90.0° | 127.5° |
| C54 | C55 | H55 | 90.0° | 132.6° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| N02 | C01 | N05 | H01 | 180.0° | 179.9° |
| C01 | N02 | C03 | C04 | 0.5° | 0.0° |
| C01 | N02 | C03 | C07 | 180.0° | 180.0° |
| N02 | C01 | N05 | C04 | 6.5° | 0.0° |
| N02 | C01 | N05 | C12 | 175.4° | 180.0° |
| N05 | C01 | N02 | C03 | 4.5° | 0.0° |
| C01 | N05 | C04 | C03 | 5.6° | 0.0° |
| C01 | N05 | C04 | C12 | 168.4° | 180.0° |
| C01 | N05 | C04 | N08 | 176.1° | 180.0° |
| C01 | N05 | C12 | C13 | 146.9° | 119.2° |
| C01 | N05 | C12 | C16 | 22.8° | 118.9° |
| C01 | N05 | C12 | H12 | 96.2° | 0.0° |
| H01 | C01 | N02 | C03 | 175.5° | 179.9° |
| H01 | C01 | N05 | C04 | 173.5° | 179.9° |
| H01 | C01 | N05 | C12 | 4.6° | 0.1° |
| N02 | C03 | C04 | C07 | 179.6° | 180.0° |
| N02 | C03 | C04 | N05 | 3.5° | 0.0° |
| N02 | C03 | C04 | N08 | 178.0° | 180.0° |
| N02 | C03 | C07 | N09 | 178.9° | 180.0° |
| N02 | C03 | C07 | N11 | 2.4° | 0.0° |
| C03 | C04 | N05 | N08 | 178.3° | 180.0° |
| C03 | C04 | N05 | C12 | 174.1° | 180.0° |
| C04 | C03 | C07 | N09 | 1.5° | 0.0° |
| C04 | C03 | C07 | N11 | 177.2° | 180.0° |
| C03 | C04 | N08 | C10 | 1.2° | 0.0° |
| C07 | C03 | C04 | N05 | 176.1° | 180.0° |
| C07 | C03 | C04 | N08 | 2.4° | 0.0° |
| C03 | C07 | N09 | N11 | 178.6° | 179.9° |
| C03 | C07 | N09 | C10 | 0.5° | 0.0° |
| C03 | C07 | N11 | C32 | 176.0° | 179.9° |
| C03 | C07 | N11 | H11 | 4.0° | 0.0° |
| N05 | C04 | N08 | C10 | 176.9° | 179.9° |
| C04 | N05 | C12 | C13 | 19.0° | 60.7° |
| C04 | N05 | C12 | C16 | 143.1° | 61.2° |
| C04 | N05 | C12 | H12 | 97.9° | 180.0° |
| N08 | C04 | N05 | C12 | 7.6° | 0.0° |
| C04 | N08 | C10 | N09 | 0.9° | 0.1° |
| C04 | N08 | C10 | C26 | 179.7° | 180.0° |
| N05 | C12 | C13 | C16 | 127.1° | 126.4° |
| N05 | C12 | C13 | H12 | 113.1° | 115.9° |
| N05 | C12 | C16 | H12 | 113.4° | 116.0° |
| N05 | C12 | C13 | C14 | 98.3° | 144.5° |
| N05 | C12 | C13 | H131 | 21.6° | 26.1° |
| N05 | C12 | C13 | H132 | 138.7° | 94.1° |
| N05 | C12 | C16 | C15 | 129.2° | 118.6° |
| N05 | C12 | C16 | H161 | 110.9° | 123.9° |
| N05 | C12 | C16 | H162 | 7.0° | 3.8° |
| C07 | N09 | C10 | N08 | 1.7° | 0.1° |
| C07 | N09 | C10 | C26 | 179.5° | 180.0° |
| N09 | C07 | N11 | C32 | 2.6° | 0.1° |
| N09 | C07 | N11 | H11 | 177.4° | 180.0° |
| N11 | C07 | N09 | C10 | 179.0° | 179.9° |
| C07 | N11 | C32 | H11 | 180.0° | 179.9° |
| C07 | N11 | C32 | C33 | 31.4° | 29.9° |
| C07 | N11 | C32 | C37 | 147.0° | 150.1° |
| N08 | C10 | N09 | C26 | 178.8° | 179.9° |
| N08 | C10 | C26 | N27 | 1.0° | 70.7° |
| N09 | C10 | C26 | N27 | 177.9° | 109.5° |
| N11 | C32 | C33 | C37 | 178.4° | 180.0° |
| N11 | C32 | C33 | C34 | 178.8° | 180.0° |
| N11 | C32 | C33 | H33 | 1.2° | 0.0° |
| N11 | C32 | C37 | C36 | 179.0° | 180.0° |
| N11 | C32 | C37 | O38 | 3.2° | 0.0° |
| H11 | N11 | C32 | C33 | 148.6° | 150.0° |
| H11 | N11 | C32 | C37 | 33.0° | 30.0° |
| C13 | C12 | C16 | H12 | 118.0° | 118.2° |
| C12 | C13 | C14 | H131 | 120.0° | 119.0° |
| C12 | C13 | C14 | H132 | 123.0° | 121.5° |
| C12 | C13 | H131 | H132 | 123.5° | 122.8° |
| C12 | C13 | C14 | C15 | 46.9° | 36.5° |
| C12 | C13 | C14 | H141 | 73.1° | 157.7° |
| C12 | C13 | C14 | H142 | 169.7° | 81.4° |
| C13 | C12 | C16 | C15 | 0.5° | 7.2° |
| C13 | C12 | C16 | H161 | 120.5° | 110.3° |
| C13 | C12 | C16 | H162 | 121.6° | 129.5° |
| C16 | C12 | C13 | C14 | 28.8° | 18.0° |
| C16 | C12 | C13 | H131 | 148.8° | 100.4° |
| C16 | C12 | C13 | H132 | 94.2° | 139.4° |
| C12 | C16 | C15 | C14 | 29.1° | 29.7° |
| C12 | C16 | C15 | H161 | 120.0° | 117.5° |
| C12 | C16 | C15 | H162 | 122.2° | 123.5° |
| C12 | C16 | C15 | H151 | 149.1° | 151.4° |
| C12 | C16 | C15 | H152 | 93.6° | 88.1° |
| C12 | C16 | H161 | H162 | 122.4° | 123.6° |
| H12 | C12 | C13 | C14 | 148.6° | 99.7° |
| H12 | C12 | C13 | H131 | 91.4° | 141.9° |
| H12 | C12 | C13 | H132 | 25.6° | 21.8° |
| H12 | C12 | C16 | C15 | 117.4° | 125.4° |
| H12 | C12 | C16 | H161 | 2.5° | 7.9° |
| H12 | C12 | C16 | H162 | 120.4° | 112.3° |
| C14 | C13 | H131 | H132 | 123.5° | 122.1° |
| C13 | C14 | C15 | H141 | 120.0° | 121.2° |
| C13 | C14 | C15 | H142 | 122.8° | 117.7° |
| C13 | C14 | H141 | H142 | 123.3° | 121.9° |
| C13 | C14 | C15 | C16 | 48.1° | 41.2° |
| C13 | C14 | C15 | H151 | 168.2° | 162.7° |
| C13 | C14 | C15 | H152 | 74.5° | 76.6° |
| H131 | C13 | C14 | C15 | 166.9° | 82.5° |
| H131 | C13 | C14 | H141 | 46.9° | 38.7° |
| H131 | C13 | C14 | H142 | 70.3° | 159.6° |
| H132 | C13 | C14 | C15 | 76.1° | 158.0° |
| H132 | C13 | C14 | H141 | 163.9° | 80.8° |
| H132 | C13 | C14 | H142 | 46.7° | 40.1° |
| C15 | C14 | H141 | H142 | 123.2° | 122.2° |
| C14 | C15 | C16 | H151 | 120.0° | 121.7° |
| C14 | C15 | C16 | H152 | 122.7° | 117.8° |
| C14 | C15 | H151 | H152 | 123.0° | 121.9° |
| C14 | C15 | C16 | H161 | 149.1° | 87.7° |
| C14 | C15 | C16 | H162 | 93.1° | 153.2° |
| H141 | C14 | C15 | C16 | 71.9° | 162.3° |
| H141 | C14 | C15 | H151 | 48.2° | 76.2° |
| H141 | C14 | C15 | H152 | 165.5° | 44.6° |
| H142 | C14 | C15 | C16 | 171.0° | 76.6° |
| H142 | C14 | C15 | H151 | 69.0° | 44.9° |
| H142 | C14 | C15 | H152 | 48.3° | 165.7° |
| C16 | C15 | H151 | H152 | 123.0° | 121.5° |
| C15 | C16 | H161 | H162 | 122.4° | 121.4° |
| H151 | C15 | C16 | H161 | 90.9° | 34.0° |
| H151 | C15 | C16 | H162 | 26.9° | 85.1° |
| H152 | C15 | C16 | H161 | 26.4° | 154.4° |
| H152 | C15 | C16 | H162 | 144.3° | 35.4° |
| C32 | C33 | C34 | H33 | 180.0° | 180.0° |
| C32 | C33 | C34 | C35 | 0.2° | 0.0° |
| C32 | C33 | C34 | H34 | 179.7° | 180.0° |
| C33 | C32 | C37 | C36 | 0.5° | 0.0° |
| C33 | C32 | C37 | O38 | 178.3° | 180.0° |
| C37 | C32 | C33 | C34 | 0.4° | 0.0° |
| C37 | C32 | C33 | H33 | 179.6° | 180.0° |
| C32 | C37 | C36 | C35 | 0.5° | 0.0° |
| C32 | C37 | C36 | O38 | 177.9° | 180.0° |
| C32 | C37 | C36 | H36 | 179.5° | 179.9° |
| C32 | C37 | O38 | C39 | 96.9° | 150.0° |
| C33 | C34 | C35 | H34 | 180.0° | 180.0° |
| C33 | C34 | C35 | C36 | 0.2° | 0.1° |
| C33 | C34 | C35 | H35 | 179.8° | 180.0° |
| H33 | C33 | C34 | C35 | 179.8° | 180.0° |
| H33 | C33 | C34 | H34 | 0.3° | 0.0° |
| C34 | C35 | C36 | H35 | 180.0° | 179.9° |
| C34 | C35 | C36 | C37 | 0.4° | 0.1° |
| C34 | C35 | C36 | H36 | 179.6° | 180.0° |
| H34 | C34 | C35 | C36 | 179.7° | 179.9° |
| H34 | C34 | C35 | H35 | 0.3° | 0.0° |
| C35 | C36 | C37 | H36 | 180.0° | 179.9° |
| C35 | C36 | C37 | O38 | 178.4° | 180.0° |
| H35 | C35 | C36 | C37 | 179.6° | 180.0° |
| H35 | C35 | C36 | H36 | 0.4° | 0.1° |
| C36 | C37 | O38 | C39 | 85.3° | 30.0° |
| H36 | C36 | C37 | O38 | 1.6° | 0.1° |
| C37 | O38 | C39 | C40 | 88.2° | 151.0° |
| C37 | O38 | C39 | H391 | 151.8° | 30.0° |
| C37 | O38 | C39 | H392 | 38.5° | 88.3° |
| O38 | C39 | C40 | H391 | 120.0° | 119.0° |
| O38 | C39 | C40 | H392 | 126.8° | 119.2° |
| O38 | C39 | H391 | H392 | 138.5° | 117.9° |
| O38 | C39 | C40 | C41 | 90.0° | 179.1° |
| O38 | C39 | C40 | H401 | 90.0° | 59.7° |
| O38 | C39 | C40 | H402 | 90.0° | 54.9° |
| C40 | C39 | H391 | H392 | 138.5° | 122.8° |
| C39 | C40 | C41 | H401 | 90.0° | 121.2° |
| C39 | C40 | C41 | H402 | 90.0° | 123.3° |
| C39 | C40 | H401 | H402 | 90.0° | 117.1° |
| C39 | C40 | C41 | N51 | 90.0° | 177.5° |
| C39 | C40 | C41 | H411 | 90.0° | 60.0° |
| C39 | C40 | C41 | H412 | 90.0° | 57.8° |
| H391 | C39 | C40 | C41 | 90.0° | 60.0° |
| H391 | C39 | C40 | H401 | 90.0° | 178.7° |
| H391 | C39 | C40 | H402 | 90.0° | 64.1° |
| H392 | C39 | C40 | C41 | 90.0° | 61.7° |
| H392 | C39 | C40 | H401 | 90.0° | 59.5° |
| H392 | C39 | C40 | H402 | 90.0° | 174.1° |
| C41 | C40 | H401 | H402 | 90.0° | 118.9° |
| C40 | C41 | N51 | H411 | 90.0° | 123.8° |
| C40 | C41 | N51 | H412 | 90.0° | 121.5° |
| C40 | C41 | H411 | H412 | 90.0° | 119.8° |
| C40 | C41 | N51 | C52 | 90.0° | 90.0° |
| C40 | C41 | N51 | C55 | 90.0° | 90.0° |
| H401 | C40 | C41 | N51 | 90.0° | 56.3° |
| H401 | C40 | C41 | H411 | 90.0° | 178.8° |
| H401 | C40 | C41 | H412 | 90.0° | 63.3° |
| H402 | C40 | C41 | N51 | 90.0° | 59.2° |
| H402 | C40 | C41 | H411 | 90.0° | 63.3° |
| H402 | C40 | C41 | H412 | 90.0° | 178.9° |
| N51 | C41 | H411 | H412 | 90.0° | 114.7° |
| C41 | N51 | C52 | C55 | 90.0° | 180.0° |
| C41 | N51 | C52 | N53 | 90.0° | 180.0° |
| C41 | N51 | C52 | H52 | 90.0° | 0.0° |
| C41 | N51 | C55 | C54 | 90.0° | 180.0° |
| C41 | N51 | C55 | H55 | 90.0° | 0.0° |
| H411 | C41 | N51 | C52 | 90.0° | 146.2° |
| H411 | C41 | N51 | C55 | 90.0° | 33.8° |
| H412 | C41 | N51 | C52 | 90.0° | 31.4° |
| H412 | C41 | N51 | C55 | 90.0° | 148.5° |
| N51 | C52 | N53 | H52 | 90.0° | 180.0° |
| N51 | C52 | N53 | C54 | 90.0° | 0.0° |
| C52 | N51 | C55 | C54 | 90.0° | 0.1° |
| C52 | N51 | C55 | H55 | 90.0° | 180.0° |
| C55 | N51 | C52 | N53 | 90.0° | 0.0° |
| C55 | N51 | C52 | H52 | 90.0° | 179.9° |
| N51 | C55 | C54 | N53 | 90.0° | 0.1° |
| N51 | C55 | C54 | H55 | 90.0° | 179.9° |
| N51 | C55 | C54 | H54 | 90.0° | 180.0° |
| C52 | N53 | C54 | C55 | 90.0° | 0.0° |
| C52 | N53 | C54 | H54 | 90.0° | 180.0° |
| H52 | C52 | N53 | C54 | 90.0° | 180.0° |
| N53 | C54 | C55 | H54 | 90.0° | 179.9° |
| N53 | C54 | C55 | H55 | 90.0° | 180.0° |
| H54 | C54 | C55 | H55 | 90.0° | 0.1° |
