R55
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O22 | C21 | doub | 1.22Å | 1.26Å | |
| C21 | C14 | sing | 1.48Å | 1.47Å | |
| C21 | N23 | sing | 1.35Å | 1.40Å | |
| C14 | C13 | doub | 1.40Å | 1.41Å | Aromatic |
| C14 | C15 | sing | 1.40Å | 1.41Å | Aromatic |
| C13 | C12 | sing | 1.38Å | 1.37Å | Aromatic |
| C13 | H13 | sing | 1.08Å | 1.10Å | |
| C12 | N11 | doub | 1.32Å | 1.40Å | Aromatic |
| C12 | H12 | sing | 1.08Å | 1.10Å | |
| N11 | C16 | sing | 1.32Å | 1.37Å | Aromatic |
| C16 | C15 | doub | 1.38Å | 1.39Å | Aromatic |
| C16 | H16 | sing | 1.08Å | 1.10Å | |
| C15 | H15 | sing | 1.08Å | 1.10Å | |
| N23 | C31 | sing | 1.47Å | 1.47Å | |
| N23 | H23 | sing | 0.97Å | 1.02Å | |
| C31 | C32 | sing | 1.54Å | 1.54Å | |
| C31 | C37 | sing | 1.51Å | 1.55Å | |
| C31 | H31 | sing | 1.09Å | 1.12Å | |
| C32 | N33 | sing | 1.48Å | 1.48Å | |
| C32 | H321 | sing | 1.09Å | 1.12Å | |
| C32 | H322 | sing | 1.09Å | 1.11Å | |
| N33 | C34 | sing | 1.44Å | 1.47Å | |
| N33 | H33 | sing | 1.01Å | 1.02Å | |
| C34 | C35 | sing | 1.53Å | 1.53Å | |
| C34 | H341 | sing | 1.09Å | 1.12Å | |
| C34 | H342 | sing | 1.09Å | 1.11Å | |
| C35 | C36 | sing | 1.46Å | 1.53Å | |
| C35 | H351 | sing | 1.09Å | 1.11Å | |
| C35 | H352 | sing | 1.09Å | 1.11Å | |
| C36 | C37 | sing | 1.56Å | 1.54Å | |
| C36 | H361 | sing | 1.09Å | 1.12Å | |
| C36 | H362 | sing | 1.09Å | 1.11Å | |
| C37 | N41 | sing | 1.47Å | 1.47Å | |
| C37 | H37 | sing | 1.09Å | 1.11Å | |
| N41 | C42 | sing | 1.35Å | 1.38Å | |
| N41 | H41 | sing | 0.97Å | 1.02Å | |
| C42 | O43 | doub | 1.22Å | 1.24Å | |
| C42 | C51 | sing | 1.48Å | 1.45Å | |
| C51 | C52 | doub | 1.40Å | 1.40Å | Aromatic |
| C51 | C56 | sing | 1.40Å | 1.40Å | Aromatic |
| C52 | C53 | sing | 1.38Å | 1.38Å | Aromatic |
| C52 | H52 | sing | 1.08Å | 1.10Å | |
| C53 | C54 | doub | 1.40Å | 1.40Å | Aromatic |
| C53 | H53 | sing | 1.08Å | 1.10Å | |
| C56 | C55 | doub | 1.38Å | 1.40Å | Aromatic |
| C56 | H56 | sing | 1.08Å | 1.10Å | |
| C55 | C54 | sing | 1.40Å | 1.40Å | Aromatic |
| C55 | H55 | sing | 1.08Å | 1.10Å | |
| C54 | C61 | sing | 1.48Å | 1.46Å | |
| C61 | O62 | doub | 1.22Å | 1.22Å | |
| C61 | C71 | sing | 1.47Å | 1.47Å | |
| C71 | C72 | doub | 1.40Å | 1.38Å | Aromatic |
| C71 | C76 | sing | 1.40Å | 1.39Å | Aromatic |
| C72 | O99 | sing | 1.36Å | 1.36Å | |
| C72 | C73 | sing | 1.39Å | 1.38Å | Aromatic |
| O99 | H99 | sing | 0.97Å | 0.95Å | |
| C73 | C74 | doub | 1.38Å | 1.37Å | Aromatic |
| C73 | H73 | sing | 1.08Å | 1.10Å | |
| C74 | C75 | sing | 1.39Å | 1.41Å | Aromatic |
| C74 | H74 | sing | 1.08Å | 1.10Å | |
| C75 | C76 | doub | 1.38Å | 1.40Å | Aromatic |
| C75 | N91 | sing | 1.40Å | 1.43Å | |
| C76 | H76 | sing | 1.08Å | 1.10Å | |
| N91 | C92 | sing | 1.47Å | 1.49Å | |
| N91 | C96 | sing | 1.47Å | 1.48Å | |
| C92 | C93 | sing | 1.53Å | 1.54Å | |
| C92 | H921 | sing | 1.09Å | 1.11Å | |
| C92 | H922 | sing | 1.09Å | 1.12Å | |
| C93 | C94 | sing | 1.53Å | 1.55Å | |
| C93 | H931 | sing | 1.09Å | 1.12Å | |
| C93 | H932 | sing | 1.09Å | 1.11Å | |
| C94 | C97 | sing | 1.53Å | 1.54Å | |
| C94 | C98 | sing | 1.53Å | 1.52Å | |
| C94 | C95 | sing | 1.53Å | 1.55Å | |
| C97 | H971 | sing | 1.09Å | 1.11Å | |
| C97 | H972 | sing | 1.09Å | 1.12Å | |
| C97 | H973 | sing | 1.09Å | 1.11Å | |
| C98 | H981 | sing | 1.09Å | 1.12Å | |
| C98 | H982 | sing | 1.09Å | 1.12Å | |
| C98 | H983 | sing | 1.09Å | 1.12Å | |
| C95 | C96 | sing | 1.53Å | 1.52Å | |
| C95 | H951 | sing | 1.09Å | 1.11Å | |
| C95 | H952 | sing | 1.09Å | 1.11Å | |
| C96 | H961 | sing | 1.09Å | 1.11Å | |
| C96 | H962 | sing | 1.09Å | 1.12Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O22 | C21 | C14 | 121.3° | 120.0° |
| O22 | C21 | N23 | 120.9° | 120.0° |
| C14 | C21 | N23 | 117.8° | 120.0° |
| C21 | C14 | C13 | 117.3° | 120.9° |
| C21 | C14 | C15 | 125.1° | 120.9° |
| C21 | N23 | C31 | 121.9° | 120.0° |
| C21 | N23 | H23 | 116.5° | 120.0° |
| C13 | C14 | C15 | 117.6° | 118.2° |
| C14 | C13 | C12 | 121.6° | 118.9° |
| C14 | C13 | H13 | 120.8° | 120.5° |
| C14 | C15 | C16 | 119.9° | 119.0° |
| C14 | C15 | H15 | 120.8° | 120.5° |
| C12 | C13 | H13 | 117.6° | 120.6° |
| C13 | C12 | N11 | 120.0° | 121.0° |
| C13 | C12 | H12 | 119.0° | 119.5° |
| N11 | C12 | H12 | 121.0° | 119.5° |
| C12 | N11 | C16 | 119.3° | 122.0° |
| N11 | C16 | C15 | 121.6° | 120.9° |
| N11 | C16 | H16 | 118.6° | 119.6° |
| C15 | C16 | H16 | 119.8° | 119.5° |
| C16 | C15 | H15 | 119.3° | 120.5° |
| C31 | N23 | H23 | 121.7° | 120.0° |
| N23 | C31 | C32 | 111.0° | 108.4° |
| N23 | C31 | C37 | 107.5° | 108.5° |
| N23 | C31 | H31 | 111.8° | 108.4° |
| C32 | C31 | C37 | 114.9° | 114.6° |
| C32 | C31 | H31 | 103.9° | 108.5° |
| C31 | C32 | N33 | 111.7° | 114.0° |
| C31 | C32 | H321 | 111.4° | 108.6° |
| C31 | C32 | H322 | 111.4° | 108.4° |
| C37 | C31 | H31 | 107.6° | 108.3° |
| C31 | C37 | C36 | 118.1° | 108.9° |
| C31 | C37 | N41 | 110.4° | 109.6° |
| C31 | C37 | H37 | 101.9° | 109.7° |
| N33 | C32 | H321 | 111.4° | 108.6° |
| N33 | C32 | H322 | 111.4° | 108.6° |
| C32 | N33 | C34 | 113.2° | 108.7° |
| C32 | N33 | H33 | 110.9° | 106.7° |
| H321 | C32 | H322 | 99.0° | 108.4° |
| C34 | N33 | H33 | 110.9° | 106.7° |
| N33 | C34 | C35 | 110.2° | 106.9° |
| N33 | C34 | H341 | 112.0° | 109.9° |
| N33 | C34 | H342 | 111.9° | 110.0° |
| C35 | C34 | H341 | 111.9° | 110.0° |
| C35 | C34 | H342 | 111.9° | 110.0° |
| C34 | C35 | C36 | 114.5° | 113.9° |
| C34 | C35 | H351 | 110.4° | 108.6° |
| C34 | C35 | H352 | 110.4° | 108.6° |
| H341 | C34 | H342 | 98.5° | 110.0° |
| C36 | C35 | H351 | 110.4° | 108.6° |
| C36 | C35 | H352 | 110.4° | 108.6° |
| C35 | C36 | C37 | 112.7° | 109.8° |
| C35 | C36 | H361 | 111.0° | 109.4° |
| C35 | C36 | H362 | 111.0° | 109.4° |
| H351 | C35 | H352 | 99.9° | 108.4° |
| C37 | C36 | H361 | 111.0° | 109.4° |
| C37 | C36 | H362 | 111.0° | 109.4° |
| C36 | C37 | N41 | 107.3° | 109.5° |
| C36 | C37 | H37 | 105.3° | 109.6° |
| H361 | C36 | H362 | 99.3° | 109.4° |
| N41 | C37 | H37 | 113.9° | 109.6° |
| C37 | N41 | C42 | 123.8° | 120.0° |
| C37 | N41 | H41 | 121.5° | 120.1° |
| C42 | N41 | H41 | 114.8° | 120.0° |
| N41 | C42 | O43 | 121.2° | 120.0° |
| N41 | C42 | C51 | 118.9° | 120.0° |
| O43 | C42 | C51 | 119.5° | 120.0° |
| C42 | C51 | C52 | 120.8° | 120.0° |
| C42 | C51 | C56 | 119.3° | 120.0° |
| C52 | C51 | C56 | 119.9° | 120.0° |
| C51 | C52 | C53 | 119.8° | 120.0° |
| C51 | C52 | H52 | 120.9° | 120.0° |
| C51 | C56 | C55 | 120.2° | 120.0° |
| C51 | C56 | H56 | 120.1° | 120.0° |
| C53 | C52 | H52 | 119.3° | 120.0° |
| C52 | C53 | C54 | 120.8° | 120.0° |
| C52 | C53 | H53 | 118.7° | 120.0° |
| C54 | C53 | H53 | 120.6° | 120.0° |
| C53 | C54 | C55 | 119.8° | 120.0° |
| C53 | C54 | C61 | 119.2° | 120.0° |
| C55 | C56 | H56 | 119.6° | 120.0° |
| C56 | C55 | C54 | 119.4° | 120.0° |
| C56 | C55 | H55 | 120.2° | 120.0° |
| C54 | C55 | H55 | 120.4° | 120.0° |
| C55 | C54 | C61 | 120.7° | 120.0° |
| C54 | C61 | O62 | 116.5° | 120.1° |
| C54 | C61 | C71 | 126.9° | 120.0° |
| O62 | C61 | C71 | 116.5° | 120.0° |
| C61 | C71 | C72 | 120.2° | 120.2° |
| C61 | C71 | C76 | 120.1° | 120.2° |
| C72 | C71 | C76 | 119.8° | 119.7° |
| C71 | C72 | O99 | 118.5° | 120.1° |
| C71 | C72 | C73 | 121.0° | 119.8° |
| C71 | C76 | C75 | 120.3° | 119.8° |
| C71 | C76 | H76 | 119.8° | 120.1° |
| O99 | C72 | C73 | 120.5° | 120.1° |
| C72 | O99 | H99 | 118.5° | 106.8° |
| C72 | C73 | C74 | 119.1° | 120.2° |
| C72 | C73 | H73 | 120.9° | 119.9° |
| C74 | C73 | H73 | 120.0° | 120.0° |
| C73 | C74 | C75 | 121.8° | 120.4° |
| C73 | C74 | H74 | 117.7° | 119.8° |
| C75 | C74 | H74 | 120.5° | 119.8° |
| C74 | C75 | C76 | 118.1° | 120.1° |
| C74 | C75 | N91 | 120.5° | 120.0° |
| C76 | C75 | N91 | 121.5° | 119.9° |
| C75 | C76 | H76 | 119.9° | 120.1° |
| C75 | N91 | C92 | 119.0° | 106.7° |
| C75 | N91 | C96 | 118.7° | 106.7° |
| C92 | N91 | C96 | 117.4° | 107.3° |
| N91 | C92 | C93 | 114.4° | 109.8° |
| N91 | C92 | H921 | 110.4° | 109.5° |
| N91 | C92 | H922 | 110.4° | 109.5° |
| N91 | C96 | C95 | 110.0° | 109.8° |
| N91 | C96 | H961 | 112.0° | 109.4° |
| N91 | C96 | H962 | 112.0° | 109.4° |
| C93 | C92 | H921 | 110.4° | 109.4° |
| C93 | C92 | H922 | 110.4° | 109.4° |
| C92 | C93 | C94 | 116.8° | 109.2° |
| C92 | C93 | H931 | 109.5° | 109.5° |
| C92 | C93 | H932 | 109.5° | 109.5° |
| H921 | C92 | H922 | 99.9° | 109.3° |
| C94 | C93 | H931 | 109.6° | 109.5° |
| C94 | C93 | H932 | 109.5° | 109.6° |
| C93 | C94 | C97 | 109.9° | 109.6° |
| C93 | C94 | C98 | 107.7° | 109.6° |
| C93 | C94 | C95 | 112.5° | 109.0° |
| H931 | C93 | H932 | 100.6° | 109.5° |
| C97 | C94 | C98 | 106.7° | 109.5° |
| C97 | C94 | C95 | 115.5° | 109.5° |
| C94 | C97 | H971 | 112.1° | 109.5° |
| C94 | C97 | H972 | 109.9° | 109.4° |
| C94 | C97 | H973 | 112.1° | 109.5° |
| C98 | C94 | C95 | 103.9° | 109.6° |
| C94 | C98 | H981 | 112.8° | 109.5° |
| C94 | C98 | H982 | 107.7° | 109.4° |
| C94 | C98 | H983 | 112.9° | 109.4° |
| C94 | C95 | C96 | 112.3° | 109.1° |
| C94 | C95 | H951 | 111.2° | 109.6° |
| C94 | C95 | H952 | 111.2° | 109.5° |
| H971 | C97 | H972 | 112.1° | 109.5° |
| H971 | C97 | H973 | 98.3° | 109.5° |
| H972 | C97 | H973 | 112.1° | 109.4° |
| H981 | C98 | H982 | 112.8° | 109.5° |
| H981 | C98 | H983 | 97.6° | 109.5° |
| H982 | C98 | H983 | 112.9° | 109.5° |
| C96 | C95 | H951 | 111.2° | 109.5° |
| C96 | C95 | H952 | 111.2° | 109.5° |
| C95 | C96 | H961 | 112.0° | 109.4° |
| C95 | C96 | H962 | 112.0° | 109.4° |
| H951 | C95 | H952 | 99.1° | 109.5° |
| H961 | C96 | H962 | 98.4° | 109.4° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O22 | C21 | C14 | N23 | 179.0° | 180.0° |
| O22 | C21 | C14 | C13 | 1.8° | 0.0° |
| O22 | C21 | C14 | C15 | 180.0° | 179.7° |
| O22 | C21 | N23 | C31 | 14.1° | 0.0° |
| O22 | C21 | N23 | H23 | 165.9° | 180.0° |
| C21 | C14 | C13 | C15 | 178.3° | 179.7° |
| C21 | C14 | C13 | C12 | 178.8° | 180.0° |
| C21 | C14 | C13 | H13 | 1.2° | 0.0° |
| C21 | C14 | C15 | C16 | 178.7° | 179.7° |
| C21 | C14 | C15 | H15 | 1.3° | 0.2° |
| C14 | C21 | N23 | C31 | 164.9° | 180.0° |
| C14 | C21 | N23 | H23 | 15.1° | 0.0° |
| N23 | C21 | C14 | C13 | 179.2° | 180.0° |
| N23 | C21 | C14 | C15 | 1.1° | 0.3° |
| C21 | N23 | C31 | H23 | 180.0° | 180.0° |
| C21 | N23 | C31 | C32 | 106.9° | 85.0° |
| C21 | N23 | C31 | C37 | 126.6° | 150.0° |
| C21 | N23 | C31 | H31 | 8.7° | 32.6° |
| C14 | C13 | C12 | H13 | 180.0° | 180.0° |
| C14 | C13 | C12 | N11 | 1.0° | 0.0° |
| C14 | C13 | C12 | H12 | 179.0° | 179.9° |
| C13 | C14 | C15 | C16 | 3.1° | 0.5° |
| C13 | C14 | C15 | H15 | 176.9° | 180.0° |
| C15 | C14 | C13 | C12 | 2.9° | 0.3° |
| C15 | C14 | C13 | H13 | 177.1° | 179.7° |
| C14 | C15 | C16 | N11 | 1.5° | 0.5° |
| C14 | C15 | C16 | H15 | 180.0° | 179.5° |
| C14 | C15 | C16 | H16 | 178.5° | 179.7° |
| C13 | C12 | N11 | H12 | 180.0° | 179.9° |
| C13 | C12 | N11 | C16 | 0.7° | 0.0° |
| H13 | C13 | C12 | N11 | 179.0° | 180.0° |
| H13 | C13 | C12 | H12 | 1.0° | 0.1° |
| C12 | N11 | C16 | C15 | 0.5° | 0.2° |
| C12 | N11 | C16 | H16 | 179.5° | 180.0° |
| H12 | C12 | N11 | C16 | 179.3° | 179.9° |
| N11 | C16 | C15 | H16 | 180.0° | 179.7° |
| N11 | C16 | C15 | H15 | 178.5° | 180.0° |
| H16 | C16 | C15 | H15 | 1.5° | 0.2° |
| N23 | C31 | C32 | C37 | 122.3° | 121.3° |
| N23 | C31 | C32 | H31 | 120.3° | 117.5° |
| N23 | C31 | C37 | H31 | 120.6° | 117.5° |
| N23 | C31 | C32 | N33 | 173.9° | 164.5° |
| N23 | C31 | C32 | H321 | 48.6° | 74.2° |
| N23 | C31 | C32 | H322 | 60.9° | 43.4° |
| N23 | C31 | C37 | C36 | 116.6° | 147.5° |
| N23 | C31 | C37 | N41 | 119.5° | 27.7° |
| N23 | C31 | C37 | H37 | 1.8° | 92.6° |
| H23 | N23 | C31 | C32 | 73.1° | 95.0° |
| H23 | N23 | C31 | C37 | 53.4° | 30.0° |
| H23 | N23 | C31 | H31 | 171.3° | 147.4° |
| C32 | C31 | C37 | H31 | 115.2° | 121.2° |
| C31 | C32 | N33 | H321 | 125.3° | 121.3° |
| C31 | C32 | N33 | H322 | 125.2° | 121.0° |
| C31 | C32 | H321 | H322 | 117.3° | 117.7° |
| C31 | C32 | N33 | C34 | 95.9° | 41.7° |
| C31 | C32 | N33 | H33 | 29.4° | 156.4° |
| C32 | C31 | C37 | C36 | 7.6° | 91.2° |
| C32 | C31 | C37 | N41 | 116.3° | 149.0° |
| C32 | C31 | C37 | H37 | 122.3° | 28.7° |
| C37 | C31 | C32 | N33 | 63.8° | 43.2° |
| C37 | C31 | C32 | H321 | 170.9° | 164.4° |
| C37 | C31 | C32 | H322 | 61.5° | 77.9° |
| C31 | C37 | C36 | C35 | 69.9° | 72.6° |
| C31 | C37 | C36 | N41 | 125.4° | 119.8° |
| C31 | C37 | C36 | H37 | 112.9° | 119.9° |
| C31 | C37 | C36 | H361 | 164.8° | 47.5° |
| C31 | C37 | C36 | H362 | 55.4° | 167.3° |
| C31 | C37 | N41 | H37 | 113.9° | 120.4° |
| C31 | C37 | N41 | C42 | 156.2° | 155.3° |
| C31 | C37 | N41 | H41 | 23.8° | 24.7° |
| H31 | C31 | C32 | N33 | 53.6° | 77.9° |
| H31 | C31 | C32 | H321 | 71.7° | 43.3° |
| H31 | C31 | C32 | H322 | 178.8° | 161.0° |
| H31 | C31 | C37 | C36 | 122.8° | 30.0° |
| H31 | C31 | C37 | N41 | 1.1° | 89.8° |
| H31 | C31 | C37 | H37 | 122.4° | 149.9° |
| N33 | C32 | H321 | H322 | 117.3° | 117.8° |
| C32 | N33 | C34 | H33 | 125.3° | 114.7° |
| C32 | N33 | C34 | C35 | 74.1° | 98.2° |
| C32 | N33 | C34 | H341 | 160.6° | 21.2° |
| C32 | N33 | C34 | H342 | 51.1° | 142.5° |
| H321 | C32 | N33 | C34 | 138.8° | 79.6° |
| H321 | C32 | N33 | H33 | 95.9° | 35.1° |
| H322 | C32 | N33 | C34 | 29.3° | 162.7° |
| H322 | C32 | N33 | H33 | 154.6° | 82.6° |
| N33 | C34 | C35 | H341 | 125.3° | 119.3° |
| N33 | C34 | C35 | H342 | 125.3° | 119.4° |
| N33 | C34 | H341 | H342 | 117.9° | 121.3° |
| N33 | C34 | C35 | C36 | 65.5° | 87.8° |
| N33 | C34 | C35 | H351 | 59.7° | 151.0° |
| N33 | C34 | C35 | H352 | 169.2° | 33.3° |
| H33 | N33 | C34 | C35 | 51.2° | 147.1° |
| H33 | N33 | C34 | H341 | 74.1° | 93.5° |
| H33 | N33 | C34 | H342 | 176.4° | 27.8° |
| C35 | C34 | H341 | H342 | 117.8° | 121.3° |
| C34 | C35 | C36 | H351 | 125.3° | 121.2° |
| C34 | C35 | C36 | H352 | 125.3° | 121.2° |
| C34 | C35 | H351 | H352 | 116.2° | 117.9° |
| C34 | C35 | C36 | C37 | 82.4° | 61.1° |
| C34 | C35 | C36 | H361 | 152.4° | 58.9° |
| C34 | C35 | C36 | H362 | 42.9° | 178.8° |
| H341 | C34 | C35 | C36 | 169.2° | 31.5° |
| H341 | C34 | C35 | H351 | 65.5° | 89.6° |
| H341 | C34 | C35 | H352 | 43.9° | 152.7° |
| H342 | C34 | C35 | C36 | 59.7° | 152.8° |
| H342 | C34 | C35 | H351 | 175.0° | 31.7° |
| H342 | C34 | C35 | H352 | 65.6° | 86.0° |
| C36 | C35 | H351 | H352 | 116.2° | 117.8° |
| C35 | C36 | C37 | H361 | 125.2° | 120.1° |
| C35 | C36 | C37 | H362 | 125.3° | 120.1° |
| C35 | C36 | H361 | H362 | 116.9° | 119.8° |
| C35 | C36 | C37 | N41 | 55.5° | 167.6° |
| C35 | C36 | C37 | H37 | 177.2° | 47.3° |
| H351 | C35 | C36 | C37 | 42.9° | 177.7° |
| H351 | C35 | C36 | H361 | 82.4° | 62.2° |
| H351 | C35 | C36 | H362 | 168.1° | 57.6° |
| H352 | C35 | C36 | C37 | 152.3° | 60.0° |
| H352 | C35 | C36 | H361 | 27.1° | 179.9° |
| H352 | C35 | C36 | H362 | 82.4° | 60.1° |
| C37 | C36 | H361 | H362 | 116.9° | 119.9° |
| C36 | C37 | N41 | H37 | 116.1° | 120.2° |
| C36 | C37 | N41 | C42 | 73.9° | 85.3° |
| C36 | C37 | N41 | H41 | 106.1° | 94.7° |
| H361 | C36 | C37 | N41 | 69.8° | 72.4° |
| H361 | C36 | C37 | H37 | 51.9° | 167.4° |
| H362 | C36 | C37 | N41 | 179.2° | 47.5° |
| H362 | C36 | C37 | H37 | 57.5° | 72.7° |
| C37 | N41 | C42 | H41 | 180.0° | 179.9° |
| C37 | N41 | C42 | O43 | 5.0° | 0.1° |
| C37 | N41 | C42 | C51 | 168.1° | 180.0° |
| H37 | C37 | N41 | C42 | 42.2° | 34.9° |
| H37 | C37 | N41 | H41 | 137.8° | 145.0° |
| N41 | C42 | O43 | C51 | 173.0° | 180.0° |
| N41 | C42 | C51 | C52 | 161.2° | 180.0° |
| N41 | C42 | C51 | C56 | 20.1° | 0.0° |
| H41 | N41 | C42 | O43 | 175.0° | 180.0° |
| H41 | N41 | C42 | C51 | 11.9° | 0.0° |
| O43 | C42 | C51 | C52 | 25.6° | 0.0° |
| O43 | C42 | C51 | C56 | 153.1° | 180.0° |
| C42 | C51 | C52 | C56 | 178.7° | 180.0° |
| C42 | C51 | C52 | C53 | 177.1° | 180.0° |
| C42 | C51 | C52 | H52 | 2.9° | 0.0° |
| C42 | C51 | C56 | C55 | 176.3° | 179.7° |
| C42 | C51 | C56 | H56 | 3.7° | 0.0° |
| C51 | C52 | C53 | H52 | 180.0° | 180.0° |
| C51 | C52 | C53 | C54 | 2.2° | 0.0° |
| C51 | C52 | C53 | H53 | 177.8° | 180.0° |
| C52 | C51 | C56 | C55 | 2.4° | 0.3° |
| C52 | C51 | C56 | H56 | 177.6° | 180.0° |
| C56 | C51 | C52 | C53 | 1.6° | 0.0° |
| C56 | C51 | C52 | H52 | 178.4° | 180.0° |
| C51 | C56 | C55 | H56 | 180.0° | 179.7° |
| C51 | C56 | C55 | C54 | 3.9° | 0.6° |
| C51 | C56 | C55 | H55 | 176.1° | 180.0° |
| C52 | C53 | C54 | H53 | 180.0° | 180.0° |
| C52 | C53 | C54 | C55 | 3.7° | 0.2° |
| C52 | C53 | C54 | C61 | 176.7° | 180.0° |
| H52 | C52 | C53 | C54 | 177.7° | 180.0° |
| H52 | C52 | C53 | H53 | 2.2° | 0.0° |
| C53 | C54 | C55 | C56 | 4.5° | 0.5° |
| C53 | C54 | C55 | C61 | 172.9° | 179.8° |
| C53 | C54 | C55 | H55 | 175.5° | 180.0° |
| C53 | C54 | C61 | O62 | 23.9° | 5.5° |
| C53 | C54 | C61 | C71 | 159.7° | 174.6° |
| H53 | C53 | C54 | C55 | 176.3° | 179.7° |
| H53 | C53 | C54 | C61 | 3.3° | 0.0° |
| C56 | C55 | C54 | H55 | 180.0° | 179.4° |
| C56 | C55 | C54 | C61 | 177.3° | 179.7° |
| H56 | C56 | C55 | C54 | 176.2° | 179.7° |
| H56 | C56 | C55 | H55 | 3.8° | 0.3° |
| C55 | C54 | C61 | O62 | 149.0° | 174.3° |
| C55 | C54 | C61 | C71 | 27.4° | 5.7° |
| H55 | C55 | C54 | C61 | 2.7° | 0.3° |
| C54 | C61 | O62 | C71 | 176.8° | 180.0° |
| C54 | C61 | C71 | C72 | 67.7° | 75.9° |
| C54 | C61 | C71 | C76 | 110.9° | 104.3° |
| O62 | C61 | C71 | C72 | 115.9° | 104.1° |
| O62 | C61 | C71 | C76 | 65.5° | 75.6° |
| C61 | C71 | C72 | C76 | 178.6° | 179.7° |
| C61 | C71 | C72 | O99 | 2.0° | 0.0° |
| C61 | C71 | C72 | C73 | 179.8° | 180.0° |
| C61 | C71 | C76 | C75 | 179.6° | 179.7° |
| C61 | C71 | C76 | H76 | 0.4° | 0.3° |
| C71 | C72 | O99 | C73 | 177.9° | 180.0° |
| C71 | C72 | O99 | H99 | 180.0° | 90.0° |
| C71 | C72 | C73 | C74 | 0.5° | 0.0° |
| C71 | C72 | C73 | H73 | 179.5° | 180.0° |
| C72 | C71 | C76 | C75 | 0.9° | 0.6° |
| C72 | C71 | C76 | H76 | 179.1° | 180.0° |
| C76 | C71 | C72 | O99 | 176.6° | 179.7° |
| C76 | C71 | C72 | C73 | 1.2° | 0.3° |
| C71 | C76 | C75 | C74 | 0.0° | 0.6° |
| C71 | C76 | C75 | H76 | 180.0° | 179.4° |
| C71 | C76 | C75 | N91 | 179.1° | 179.7° |
| O99 | C72 | C73 | C74 | 177.3° | 180.0° |
| O99 | C72 | C73 | H73 | 2.7° | 0.1° |
| C73 | C72 | O99 | H99 | 2.1° | 90.0° |
| C72 | C73 | C74 | H73 | 180.0° | 179.9° |
| C72 | C73 | C74 | C75 | 0.4° | 0.0° |
| C72 | C73 | C74 | H74 | 179.6° | 179.9° |
| C73 | C74 | C75 | H74 | 180.0° | 179.9° |
| C73 | C74 | C75 | C76 | 0.6° | 0.3° |
| C73 | C74 | C75 | N91 | 179.8° | 180.0° |
| H73 | C73 | C74 | C75 | 179.6° | 180.0° |
| H73 | C73 | C74 | H74 | 0.4° | 0.0° |
| C74 | C75 | C76 | N91 | 179.2° | 179.7° |
| C74 | C75 | C76 | H76 | 180.0° | 180.0° |
| C74 | C75 | N91 | C92 | 171.8° | 0.1° |
| C74 | C75 | N91 | C96 | 33.6° | 114.5° |
| H74 | C74 | C75 | C76 | 179.4° | 179.8° |
| H74 | C74 | C75 | N91 | 0.2° | 0.1° |
| C76 | C75 | N91 | C92 | 7.3° | 179.7° |
| C76 | C75 | N91 | C96 | 147.3° | 65.2° |
| N91 | C75 | C76 | H76 | 0.9° | 0.3° |
| C75 | N91 | C92 | C96 | 155.0° | 114.1° |
| C75 | N91 | C92 | C93 | 163.4° | 179.7° |
| C75 | N91 | C92 | H921 | 71.4° | 60.2° |
| C75 | N91 | C92 | H922 | 38.1° | 59.7° |
| C75 | N91 | C96 | C95 | 150.2° | 179.7° |
| C75 | N91 | C96 | H961 | 24.9° | 60.2° |
| C75 | N91 | C96 | H962 | 84.5° | 59.6° |
| N91 | C92 | C93 | H921 | 125.3° | 120.1° |
| N91 | C92 | C93 | H922 | 125.2° | 120.1° |
| N91 | C92 | H921 | H922 | 116.2° | 119.9° |
| N91 | C92 | C93 | C94 | 32.0° | 61.3° |
| N91 | C92 | C93 | H931 | 157.2° | 58.6° |
| N91 | C92 | C93 | H932 | 93.3° | 178.7° |
| C92 | N91 | C96 | C95 | 54.8° | 65.6° |
| C92 | N91 | C96 | H961 | 179.9° | 174.3° |
| C92 | N91 | C96 | H962 | 70.5° | 54.4° |
| C96 | N91 | C92 | C93 | 41.7° | 65.6° |
| C96 | N91 | C92 | H921 | 83.6° | 174.3° |
| C96 | N91 | C92 | H922 | 166.9° | 54.4° |
| N91 | C96 | C95 | C94 | 57.9° | 61.3° |
| N91 | C96 | C95 | H961 | 125.3° | 120.1° |
| N91 | C96 | C95 | H962 | 125.3° | 120.1° |
| N91 | C96 | C95 | H951 | 176.8° | 178.7° |
| N91 | C96 | C95 | H952 | 67.3° | 58.6° |
| N91 | C96 | H961 | H962 | 117.9° | 119.8° |
| C93 | C92 | H921 | H922 | 116.3° | 119.7° |
| C92 | C93 | C94 | H931 | 125.3° | 119.9° |
| C92 | C93 | C94 | H932 | 125.2° | 119.9° |
| C92 | C93 | H931 | H932 | 115.3° | 120.1° |
| C92 | C93 | C94 | C97 | 93.6° | 64.3° |
| C92 | C93 | C94 | C98 | 150.5° | 175.6° |
| C92 | C93 | C94 | C95 | 36.6° | 55.6° |
| H921 | C92 | C93 | C94 | 93.3° | 178.5° |
| H921 | C92 | C93 | H931 | 32.0° | 61.6° |
| H921 | C92 | C93 | H932 | 141.5° | 58.5° |
| H922 | C92 | C93 | C94 | 157.2° | 58.8° |
| H922 | C92 | C93 | H931 | 77.5° | 178.7° |
| H922 | C92 | C93 | H932 | 32.0° | 61.2° |
| C94 | C93 | H931 | H932 | 115.3° | 120.2° |
| C93 | C94 | C97 | C98 | 116.5° | 120.2° |
| C93 | C94 | C97 | C95 | 128.6° | 119.6° |
| C93 | C94 | C98 | C95 | 119.5° | 119.6° |
| C93 | C94 | C97 | H971 | 54.7° | 179.8° |
| C93 | C94 | C97 | H972 | 180.0° | 59.8° |
| C93 | C94 | C97 | H973 | 54.7° | 60.2° |
| C93 | C94 | C98 | H981 | 54.8° | 60.2° |
| C93 | C94 | C98 | H982 | 180.0° | 59.8° |
| C93 | C94 | C98 | H983 | 54.8° | 179.8° |
| C93 | C94 | C95 | C96 | 49.7° | 55.5° |
| C93 | C94 | C95 | H951 | 175.0° | 175.5° |
| C93 | C94 | C95 | H952 | 75.6° | 64.3° |
| H931 | C93 | C94 | C97 | 31.7° | 175.8° |
| H931 | C93 | C94 | C98 | 84.2° | 55.7° |
| H931 | C93 | C94 | C95 | 161.9° | 64.3° |
| H932 | C93 | C94 | C97 | 141.2° | 55.7° |
| H932 | C93 | C94 | C98 | 25.3° | 64.5° |
| H932 | C93 | C94 | C95 | 88.6° | 175.5° |
| C97 | C94 | C98 | C95 | 122.5° | 120.2° |
| C94 | C97 | H971 | H972 | 124.1° | 120.0° |
| C94 | C97 | H971 | H973 | 118.0° | 120.0° |
| C94 | C97 | H972 | H973 | 125.3° | 120.0° |
| C97 | C94 | C98 | H981 | 63.2° | 60.0° |
| C97 | C94 | C98 | H982 | 62.0° | 180.0° |
| C97 | C94 | C98 | H983 | 172.7° | 60.0° |
| C97 | C94 | C95 | C96 | 77.6° | 64.4° |
| C97 | C94 | C95 | H951 | 47.7° | 55.6° |
| C97 | C94 | C95 | H952 | 157.2° | 175.8° |
| C98 | C94 | C97 | H971 | 171.2° | 60.0° |
| C98 | C94 | C97 | H972 | 63.5° | 179.9° |
| C98 | C94 | C97 | H973 | 61.8° | 60.0° |
| C94 | C98 | H981 | H982 | 122.4° | 120.0° |
| C94 | C98 | H981 | H983 | 118.8° | 120.0° |
| C94 | C98 | H982 | H983 | 125.3° | 119.9° |
| C98 | C94 | C95 | C96 | 165.9° | 175.5° |
| C98 | C94 | C95 | H951 | 68.8° | 64.6° |
| C98 | C94 | C95 | H952 | 40.6° | 55.6° |
| C95 | C94 | C97 | H971 | 73.9° | 60.2° |
| C95 | C94 | C97 | H972 | 51.4° | 59.8° |
| C95 | C94 | C97 | H973 | 176.7° | 179.8° |
| C95 | C94 | C98 | H981 | 174.3° | 179.8° |
| C95 | C94 | C98 | H982 | 60.5° | 59.8° |
| C95 | C94 | C98 | H983 | 64.8° | 60.2° |
| C94 | C95 | C96 | H951 | 125.3° | 120.0° |
| C94 | C95 | C96 | H952 | 125.3° | 119.8° |
| C94 | C95 | H951 | H952 | 117.0° | 120.2° |
| C94 | C95 | C96 | H961 | 176.8° | 178.6° |
| C94 | C95 | C96 | H962 | 67.3° | 58.8° |
| H971 | C97 | H972 | H973 | 109.4° | 120.0° |
| H981 | C98 | H982 | H983 | 109.5° | 120.1° |
| C96 | C95 | H951 | H952 | 117.1° | 120.1° |
| C95 | C96 | H961 | H962 | 118.0° | 119.8° |
| H951 | C95 | C96 | H961 | 51.5° | 58.6° |
| H951 | C95 | C96 | H962 | 57.9° | 61.2° |
| H952 | C95 | C96 | H961 | 57.9° | 61.6° |
| H952 | C95 | C96 | H962 | 167.4° | 178.6° |
