8LB
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C20 | C21 | doub | 1.38Å | 1.39Å | Aromatic |
| C20 | C19 | sing | 1.38Å | 1.39Å | Aromatic |
| C21 | C16 | sing | 1.38Å | 1.39Å | Aromatic |
| C19 | C18 | doub | 1.38Å | 1.40Å | Aromatic |
| C16 | C15 | sing | 1.51Å | 1.54Å | |
| C16 | C17 | doub | 1.38Å | 1.39Å | Aromatic |
| C15 | O06 | sing | 1.45Å | 1.40Å | |
| C18 | C17 | sing | 1.38Å | 1.38Å | Aromatic |
| O06 | C14 | sing | 1.35Å | 1.38Å | |
| O07 | C14 | doub | 1.22Å | 1.18Å | |
| C14 | N04 | sing | 1.35Å | 1.41Å | |
| N04 | C13 | sing | 1.47Å | 1.44Å | |
| C13 | P01 | sing | 1.82Å | 1.84Å | |
| O01 | P01 | doub | 1.48Å | 1.53Å | |
| O05 | P01 | sing | 1.61Å | 1.52Å | |
| P01 | N01 | sing | 1.68Å | 1.69Å | |
| O02 | C12 | doub | 1.21Å | 1.27Å | |
| O03 | C12 | sing | 1.34Å | 1.26Å | |
| C12 | C07 | sing | 1.51Å | 1.52Å | |
| N01 | C01 | sing | 1.47Å | 1.46Å | |
| C07 | N02 | sing | 1.46Å | 1.44Å | |
| C07 | C08 | sing | 1.53Å | 1.52Å | |
| N02 | C06 | sing | 1.35Å | 1.41Å | |
| C06 | O04 | doub | 1.21Å | 1.21Å | |
| C06 | C01 | sing | 1.51Å | 1.52Å | |
| C01 | C02 | sing | 1.53Å | 1.52Å | |
| C08 | C09 | sing | 1.53Å | 1.51Å | |
| C09 | C10 | sing | 1.53Å | 1.54Å | |
| C02 | C03 | sing | 1.53Å | 1.52Å | |
| C11 | C10 | sing | 1.53Å | 1.52Å | |
| C05 | C03 | sing | 1.53Å | 1.52Å | |
| C03 | C04 | sing | 1.53Å | 1.53Å | |
| C10 | H1 | sing | 1.09Å | 1.10Å | |
| C10 | H2 | sing | 1.09Å | 1.10Å | |
| C11 | H3 | sing | 1.09Å | 1.10Å | |
| C11 | H4 | sing | 1.09Å | 1.10Å | |
| C13 | H6 | sing | 1.09Å | 1.10Å | |
| C13 | H7 | sing | 1.09Å | 1.10Å | |
| C15 | H8 | sing | 1.09Å | 1.10Å | |
| C15 | H9 | sing | 1.09Å | 1.10Å | |
| C19 | H10 | sing | 1.08Å | 1.08Å | |
| C20 | H11 | sing | 1.08Å | 1.08Å | |
| C21 | H12 | sing | 1.08Å | 1.08Å | |
| N01 | H13 | sing | 1.01Å | 1.00Å | |
| C01 | H14 | sing | 1.09Å | 1.10Å | |
| C02 | H15 | sing | 1.09Å | 1.10Å | |
| C02 | H16 | sing | 1.09Å | 1.10Å | |
| C03 | H17 | sing | 1.09Å | 1.10Å | |
| C04 | H18 | sing | 1.09Å | 1.10Å | |
| C04 | H19 | sing | 1.09Å | 1.10Å | |
| C04 | H20 | sing | 1.09Å | 1.10Å | |
| C05 | H21 | sing | 1.09Å | 1.10Å | |
| C05 | H22 | sing | 1.09Å | 1.10Å | |
| C05 | H23 | sing | 1.09Å | 1.10Å | |
| N02 | H24 | sing | 0.97Å | 1.00Å | |
| C07 | H25 | sing | 1.09Å | 1.10Å | |
| O03 | H26 | sing | 0.97Å | 0.95Å | |
| O05 | H27 | sing | 0.97Å | 0.95Å | |
| N04 | H28 | sing | 0.97Å | 1.00Å | |
| C17 | H29 | sing | 1.08Å | 1.08Å | |
| C18 | H30 | sing | 1.08Å | 1.08Å | |
| C08 | H31 | sing | 1.09Å | 1.10Å | |
| C08 | H32 | sing | 1.09Å | 1.10Å | |
| C09 | H33 | sing | 1.09Å | 1.10Å | |
| C09 | H34 | sing | 1.09Å | 1.10Å | |
| C11 | N1 | sing | 1.47Å | 53.00Å | |
| N1 | H5 | sing | 1.01Å | 0.00Å | |
| N1 | H35 | sing | 1.01Å | 0.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C21 | C20 | C19 | 119.8° | 120.0° |
| C20 | C21 | C16 | 120.4° | 120.0° |
| C21 | C20 | H11 | 120.1° | 120.0° |
| C20 | C21 | H12 | 119.8° | 120.0° |
| C20 | C19 | C18 | 119.6° | 120.0° |
| C20 | C19 | H10 | 120.2° | 120.0° |
| C19 | C20 | H11 | 120.1° | 120.0° |
| C21 | C16 | C15 | 120.9° | 120.0° |
| C21 | C16 | C17 | 119.6° | 120.0° |
| C16 | C21 | H12 | 119.8° | 120.0° |
| C19 | C18 | C17 | 120.5° | 120.0° |
| C18 | C19 | H10 | 120.2° | 120.0° |
| C19 | C18 | H30 | 119.8° | 120.0° |
| C15 | C16 | C17 | 119.6° | 120.0° |
| C16 | C15 | O06 | 110.6° | 109.5° |
| C16 | C15 | H8 | 109.2° | 109.5° |
| C16 | C15 | H9 | 109.2° | 109.4° |
| C16 | C17 | C18 | 120.2° | 120.0° |
| C16 | C17 | H29 | 119.9° | 120.0° |
| C15 | O06 | C14 | 118.1° | 117.0° |
| O06 | C15 | H8 | 109.2° | 109.5° |
| O06 | C15 | H9 | 109.2° | 109.5° |
| C18 | C17 | H29 | 119.9° | 120.0° |
| C17 | C18 | H30 | 119.8° | 120.0° |
| O06 | C14 | O07 | 127.7° | 120.0° |
| O06 | C14 | N04 | 109.1° | 120.0° |
| O07 | C14 | N04 | 123.1° | 120.0° |
| C14 | N04 | C13 | 123.3° | 120.0° |
| C14 | N04 | H28 | 118.4° | 120.0° |
| N04 | C13 | P01 | 108.5° | 109.5° |
| N04 | C13 | H6 | 109.7° | 109.5° |
| N04 | C13 | H7 | 109.7° | 109.4° |
| C13 | N04 | H28 | 118.3° | 120.0° |
| C13 | P01 | O01 | 111.6° | 109.5° |
| C13 | P01 | O05 | 108.8° | 109.5° |
| C13 | P01 | N01 | 103.9° | 109.5° |
| P01 | C13 | H6 | 109.7° | 109.5° |
| P01 | C13 | H7 | 109.7° | 109.5° |
| O01 | P01 | O05 | 110.3° | 109.5° |
| O01 | P01 | N01 | 109.3° | 109.4° |
| O05 | P01 | N01 | 112.8° | 109.5° |
| P01 | O05 | H27 | 109.5° | 114.0° |
| P01 | N01 | C01 | 118.8° | 111.0° |
| P01 | N01 | H13 | 107.1° | 111.0° |
| O02 | C12 | O03 | 122.6° | 120.1° |
| O02 | C12 | C07 | 119.6° | 120.0° |
| O03 | C12 | C07 | 117.9° | 120.0° |
| C12 | O03 | H26 | 109.5° | 117.0° |
| C12 | C07 | N02 | 109.3° | 109.5° |
| C12 | C07 | C08 | 113.2° | 109.5° |
| C12 | C07 | H25 | 106.9° | 109.4° |
| N01 | C01 | C06 | 110.5° | 109.4° |
| N01 | C01 | C02 | 107.1° | 109.4° |
| C01 | N01 | H13 | 107.1° | 111.0° |
| N01 | C01 | H14 | 110.6° | 109.5° |
| N02 | C07 | C08 | 112.4° | 109.5° |
| C07 | N02 | C06 | 119.8° | 120.0° |
| C07 | N02 | H24 | 120.1° | 120.0° |
| N02 | C07 | H25 | 107.9° | 109.4° |
| C07 | C08 | C09 | 112.2° | 109.5° |
| C08 | C07 | H25 | 106.9° | 109.5° |
| C07 | C08 | H31 | 108.8° | 109.5° |
| C07 | C08 | H32 | 108.8° | 109.5° |
| N02 | C06 | O04 | 121.2° | 119.9° |
| N02 | C06 | C01 | 115.8° | 120.0° |
| C06 | N02 | H24 | 120.1° | 120.0° |
| O04 | C06 | C01 | 122.9° | 120.1° |
| C06 | C01 | C02 | 109.1° | 109.5° |
| C06 | C01 | H14 | 109.8° | 109.5° |
| C01 | C02 | C03 | 114.2° | 109.5° |
| C02 | C01 | H14 | 109.7° | 109.5° |
| C01 | C02 | H15 | 108.3° | 109.5° |
| C01 | C02 | H16 | 108.3° | 109.4° |
| C08 | C09 | C10 | 111.2° | 109.5° |
| C09 | C08 | H31 | 108.8° | 109.5° |
| C09 | C08 | H32 | 108.8° | 109.4° |
| C08 | C09 | H33 | 109.1° | 109.5° |
| C08 | C09 | H34 | 109.1° | 109.5° |
| C09 | C10 | C11 | 113.4° | 109.5° |
| C09 | C10 | H1 | 108.5° | 109.5° |
| C09 | C10 | H2 | 108.5° | 109.4° |
| C10 | C09 | H33 | 109.0° | 109.5° |
| C10 | C09 | H34 | 109.0° | 109.4° |
| C02 | C03 | C05 | 112.4° | 109.5° |
| C02 | C03 | C04 | 111.4° | 109.5° |
| C03 | C02 | H15 | 108.3° | 109.5° |
| C03 | C02 | H16 | 108.3° | 109.5° |
| C02 | C03 | H17 | 107.6° | 109.5° |
| C11 | C10 | H1 | 108.5° | 109.5° |
| C11 | C10 | H2 | 108.5° | 109.5° |
| C10 | C11 | H3 | 115.6° | 109.5° |
| C10 | C11 | H4 | 115.6° | 109.5° |
| C10 | C11 | N1 | 83.2° | 109.5° |
| C05 | C03 | C04 | 110.1° | 109.4° |
| C05 | C03 | H17 | 107.6° | 109.4° |
| C03 | C05 | H21 | 109.5° | 109.4° |
| C03 | C05 | H22 | 109.5° | 109.5° |
| C03 | C05 | H23 | 109.5° | 109.5° |
| C04 | C03 | H17 | 107.6° | 109.5° |
| C03 | C04 | H18 | 109.5° | 109.5° |
| C03 | C04 | H19 | 109.5° | 109.4° |
| C03 | C04 | H20 | 109.5° | 109.4° |
| H1 | C10 | H2 | 109.5° | 109.4° |
| H3 | C11 | H4 | 109.4° | 109.5° |
| H3 | C11 | N1 | 115.6° | 109.5° |
| H4 | C11 | N1 | 115.6° | 109.4° |
| H6 | C13 | H7 | 109.5° | 109.4° |
| H8 | C15 | H9 | 109.5° | 109.5° |
| H15 | C02 | H16 | 109.4° | 109.5° |
| H18 | C04 | H19 | 109.5° | 109.5° |
| H18 | C04 | H20 | 109.5° | 109.5° |
| H19 | C04 | H20 | 109.4° | 109.5° |
| H21 | C05 | H22 | 109.5° | 109.4° |
| H21 | C05 | H23 | 109.4° | 109.5° |
| H22 | C05 | H23 | 109.5° | 109.5° |
| H31 | C08 | H32 | 109.5° | 109.5° |
| H33 | C09 | H34 | 109.5° | 109.5° |
| C11 | N1 | H5 | 90.0° | 111.0° |
| C11 | N1 | H35 | 90.0° | 111.0° |
| H5 | N1 | H35 | 90.0° | 111.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C21 | C20 | C19 | H11 | 180.0° | 180.0° |
| C20 | C21 | C16 | H12 | 180.0° | 180.0° |
| C21 | C20 | C19 | C18 | 0.7° | 0.3° |
| C20 | C21 | C16 | C15 | 179.6° | 180.0° |
| C20 | C21 | C16 | C17 | 1.7° | 0.3° |
| C21 | C20 | C19 | H10 | 179.3° | 179.9° |
| C19 | C20 | C21 | C16 | 0.5° | 0.0° |
| C20 | C19 | C18 | H10 | 180.0° | 179.6° |
| C20 | C19 | C18 | C17 | 0.7° | 0.3° |
| C19 | C20 | C21 | H12 | 179.5° | 180.0° |
| C20 | C19 | C18 | H30 | 179.3° | 180.0° |
| C21 | C16 | C15 | C17 | 178.6° | 179.7° |
| C21 | C16 | C15 | O06 | 115.0° | 89.7° |
| C21 | C16 | C17 | C18 | 1.7° | 0.2° |
| C21 | C16 | C15 | H8 | 124.9° | 30.3° |
| C21 | C16 | C15 | H9 | 5.2° | 150.3° |
| C16 | C21 | C20 | H11 | 179.5° | 180.0° |
| C21 | C16 | C17 | H29 | 178.3° | 179.8° |
| C19 | C18 | C17 | C16 | 0.5° | 0.1° |
| C19 | C18 | C17 | H30 | 180.0° | 179.6° |
| C18 | C19 | C20 | H11 | 179.3° | 179.7° |
| C19 | C18 | C17 | H29 | 179.5° | 179.9° |
| C16 | C15 | O06 | H8 | 120.2° | 120.0° |
| C16 | C15 | O06 | H9 | 120.2° | 120.0° |
| C15 | C16 | C17 | C18 | 179.6° | 179.9° |
| C16 | C15 | O06 | C14 | 111.9° | 180.0° |
| C16 | C15 | H8 | H9 | 119.5° | 119.9° |
| C15 | C16 | C21 | H12 | 0.3° | 0.0° |
| C15 | C16 | C17 | H29 | 0.3° | 0.1° |
| C17 | C16 | C15 | O06 | 63.7° | 90.0° |
| C16 | C17 | C18 | H29 | 180.0° | 180.0° |
| C17 | C16 | C15 | H8 | 56.5° | 150.0° |
| C17 | C16 | C15 | H9 | 176.1° | 30.0° |
| C17 | C16 | C21 | H12 | 178.3° | 179.8° |
| C16 | C17 | C18 | H30 | 179.5° | 179.7° |
| C15 | O06 | C14 | O07 | 12.5° | 0.0° |
| C15 | O06 | C14 | N04 | 168.8° | 180.0° |
| O06 | C15 | H8 | H9 | 119.5° | 120.0° |
| C17 | C18 | C19 | H10 | 179.3° | 180.0° |
| O06 | C14 | O07 | N04 | 178.6° | 180.0° |
| O06 | C14 | N04 | C13 | 178.0° | 180.0° |
| C14 | O06 | C15 | H8 | 8.2° | 60.0° |
| C14 | O06 | C15 | H9 | 127.9° | 60.0° |
| O06 | C14 | N04 | H28 | 2.0° | 0.0° |
| O07 | C14 | N04 | C13 | 0.8° | 0.0° |
| O07 | C14 | N04 | H28 | 179.2° | 180.0° |
| C14 | N04 | C13 | H28 | 180.0° | 180.0° |
| C14 | N04 | C13 | P01 | 145.6° | 95.0° |
| C14 | N04 | C13 | H6 | 94.5° | 25.0° |
| C14 | N04 | C13 | H7 | 25.8° | 145.0° |
| N04 | C13 | P01 | H6 | 119.9° | 120.1° |
| N04 | C13 | P01 | H7 | 119.9° | 120.0° |
| N04 | C13 | P01 | O01 | 81.4° | 60.1° |
| N04 | C13 | P01 | O05 | 40.5° | 60.0° |
| N04 | C13 | P01 | N01 | 160.9° | 180.0° |
| N04 | C13 | H6 | H7 | 120.5° | 119.9° |
| C13 | P01 | O01 | O05 | 121.1° | 120.0° |
| C13 | P01 | O01 | N01 | 114.4° | 120.0° |
| C13 | P01 | O05 | N01 | 114.7° | 120.0° |
| C13 | P01 | N01 | C01 | 145.4° | 174.9° |
| P01 | C13 | H6 | H7 | 120.4° | 120.0° |
| C13 | P01 | N01 | H13 | 93.3° | 61.2° |
| C13 | P01 | O05 | H27 | 122.8° | 64.9° |
| P01 | C13 | N04 | H28 | 34.4° | 85.0° |
| O01 | P01 | O05 | N01 | 122.6° | 120.0° |
| O01 | P01 | N01 | C01 | 26.1° | 55.0° |
| O01 | P01 | C13 | H6 | 158.7° | 60.0° |
| O01 | P01 | C13 | H7 | 38.4° | 180.0° |
| O01 | P01 | N01 | H13 | 147.4° | 178.9° |
| O01 | P01 | O05 | H27 | 0.0° | 175.0° |
| O05 | P01 | N01 | C01 | 97.0° | 65.1° |
| O05 | P01 | C13 | H6 | 79.3° | 180.0° |
| O05 | P01 | C13 | H7 | 160.4° | 60.0° |
| O05 | P01 | N01 | H13 | 24.3° | 58.8° |
| P01 | N01 | C01 | H13 | 121.3° | 123.9° |
| P01 | N01 | C01 | C06 | 85.6° | 96.2° |
| P01 | N01 | C01 | C02 | 155.6° | 143.8° |
| N01 | P01 | C13 | H6 | 41.0° | 60.0° |
| N01 | P01 | C13 | H7 | 79.3° | 60.0° |
| P01 | N01 | C01 | H14 | 36.1° | 23.8° |
| N01 | P01 | O05 | H27 | 122.5° | 55.1° |
| O02 | C12 | O03 | C07 | 179.5° | 180.0° |
| O02 | C12 | C07 | N02 | 8.1° | 0.0° |
| O02 | C12 | C07 | C08 | 118.1° | 120.0° |
| O02 | C12 | C07 | H25 | 124.5° | 120.0° |
| O02 | C12 | O03 | H26 | 0.0° | 0.0° |
| O03 | C12 | C07 | N02 | 171.5° | 180.0° |
| O03 | C12 | C07 | C08 | 62.4° | 60.0° |
| O03 | C12 | C07 | H25 | 55.0° | 60.0° |
| C12 | C07 | N02 | C08 | 126.6° | 120.0° |
| C12 | C07 | N02 | H25 | 115.8° | 120.0° |
| C12 | C07 | C08 | H25 | 117.4° | 120.0° |
| C12 | C07 | N02 | C06 | 139.7° | 84.9° |
| C12 | C07 | C08 | C09 | 60.7° | 175.0° |
| C12 | C07 | N02 | H24 | 40.3° | 95.0° |
| C07 | C12 | O03 | H26 | 179.5° | 180.0° |
| C12 | C07 | C08 | H31 | 59.7° | 65.0° |
| C12 | C07 | C08 | H32 | 178.9° | 55.0° |
| N01 | C01 | C06 | N02 | 32.6° | 180.0° |
| N01 | C01 | C06 | O04 | 150.8° | 0.0° |
| N01 | C01 | C06 | C02 | 117.5° | 120.0° |
| N01 | C01 | C06 | H14 | 122.3° | 120.0° |
| N01 | C01 | C02 | H14 | 120.1° | 120.0° |
| N01 | C01 | C02 | C03 | 178.5° | 65.2° |
| N01 | C01 | C02 | H15 | 57.8° | 54.8° |
| N01 | C01 | C02 | H16 | 60.8° | 174.8° |
| N02 | C07 | C08 | H25 | 118.1° | 120.0° |
| C07 | N02 | C06 | H24 | 180.0° | 179.9° |
| C07 | N02 | C06 | O04 | 1.9° | 0.1° |
| C07 | N02 | C06 | C01 | 178.5° | 180.0° |
| N02 | C07 | C08 | C09 | 63.7° | 65.0° |
| N02 | C07 | C08 | H31 | 175.8° | 55.1° |
| N02 | C07 | C08 | H32 | 56.6° | 175.1° |
| C08 | C07 | N02 | C06 | 93.7° | 155.0° |
| C07 | C08 | C09 | H31 | 120.4° | 120.0° |
| C07 | C08 | C09 | H32 | 120.4° | 120.0° |
| C07 | C08 | C09 | C10 | 178.1° | 180.0° |
| C08 | C07 | N02 | H24 | 86.3° | 25.1° |
| C07 | C08 | H31 | H32 | 118.7° | 120.0° |
| C07 | C08 | C09 | H33 | 57.8° | 60.0° |
| C07 | C08 | C09 | H34 | 61.7° | 60.0° |
| N02 | C06 | O04 | C01 | 176.4° | 180.0° |
| N02 | C06 | C01 | C02 | 84.8° | 60.0° |
| N02 | C06 | C01 | H14 | 154.9° | 60.0° |
| C06 | N02 | C07 | H25 | 23.9° | 35.0° |
| O04 | C06 | C01 | C02 | 91.7° | 120.0° |
| O04 | C06 | C01 | H14 | 28.5° | 120.0° |
| O04 | C06 | N02 | H24 | 178.1° | 180.0° |
| C06 | C01 | C02 | H14 | 120.3° | 120.1° |
| C06 | C01 | C02 | C03 | 61.9° | 174.9° |
| C06 | C01 | N01 | H13 | 153.1° | 139.9° |
| C06 | C01 | C02 | H15 | 177.4° | 65.1° |
| C06 | C01 | C02 | H16 | 58.8° | 54.9° |
| C01 | C06 | N02 | H24 | 1.5° | 0.1° |
| C01 | C02 | C03 | H15 | 120.7° | 120.0° |
| C01 | C02 | C03 | H16 | 120.7° | 120.0° |
| C01 | C02 | C03 | C05 | 68.3° | 66.0° |
| C01 | C02 | C03 | C04 | 167.6° | 174.0° |
| C02 | C01 | N01 | H13 | 34.3° | 19.9° |
| C01 | C02 | H15 | H16 | 117.8° | 120.0° |
| C01 | C02 | C03 | H17 | 49.9° | 54.0° |
| C08 | C09 | C10 | H33 | 120.3° | 120.0° |
| C08 | C09 | C10 | H34 | 120.3° | 120.0° |
| C08 | C09 | C10 | C11 | 67.9° | 180.0° |
| C08 | C09 | C10 | H1 | 52.6° | 59.9° |
| C08 | C09 | C10 | H2 | 171.5° | 60.0° |
| C09 | C08 | C07 | H25 | 178.1° | 55.0° |
| C09 | C08 | H31 | H32 | 118.8° | 120.0° |
| C08 | C09 | H33 | H34 | 119.2° | 120.0° |
| C09 | C10 | C11 | H1 | 120.6° | 120.1° |
| C09 | C10 | C11 | H2 | 120.6° | 120.0° |
| C09 | C10 | H1 | H2 | 118.2° | 119.9° |
| C09 | C10 | C11 | H3 | 17.9° | 60.0° |
| C09 | C10 | C11 | H4 | 147.5° | 60.0° |
| C10 | C09 | C08 | H31 | 61.5° | 60.0° |
| C10 | C09 | C08 | H32 | 57.7° | 60.0° |
| C10 | C09 | H33 | H34 | 119.2° | 120.0° |
| C09 | C10 | C11 | N1 | 97.3° | 180.0° |
| C02 | C03 | C05 | C04 | 124.8° | 120.0° |
| C02 | C03 | C05 | H17 | 118.2° | 120.0° |
| C02 | C03 | C04 | H17 | 117.7° | 120.0° |
| C03 | C02 | C01 | H14 | 58.4° | 54.8° |
| C03 | C02 | H15 | H16 | 117.8° | 120.0° |
| C02 | C03 | C04 | H18 | 180.0° | 60.0° |
| C02 | C03 | C04 | H19 | 60.0° | 180.0° |
| C02 | C03 | C04 | H20 | 60.0° | 60.0° |
| C02 | C03 | C05 | H21 | 180.0° | 60.0° |
| C02 | C03 | C05 | H22 | 60.0° | 60.0° |
| C02 | C03 | C05 | H23 | 60.0° | 180.0° |
| C11 | C10 | H1 | H2 | 118.2° | 120.0° |
| C10 | C11 | H3 | H4 | 132.5° | 120.0° |
| C10 | C11 | H3 | N1 | 94.8° | 120.0° |
| C10 | C11 | H4 | N1 | 94.9° | 120.0° |
| C11 | C10 | C09 | H33 | 171.8° | 60.0° |
| C11 | C10 | C09 | H34 | 52.3° | 60.0° |
| C10 | C11 | N1 | H5 | 90.0° | 56.1° |
| C10 | C11 | N1 | H35 | 90.0° | 180.0° |
| C05 | C03 | C04 | H17 | 117.0° | 119.9° |
| C05 | C03 | C02 | H15 | 52.4° | 174.0° |
| C05 | C03 | C02 | H16 | 170.9° | 53.9° |
| C05 | C03 | C04 | H18 | 54.6° | 60.0° |
| C05 | C03 | C04 | H19 | 65.4° | 60.0° |
| C05 | C03 | C04 | H20 | 174.6° | 180.0° |
| C03 | C05 | H21 | H22 | 120.0° | 119.9° |
| C03 | C05 | H21 | H23 | 120.0° | 120.1° |
| C03 | C05 | H22 | H23 | 120.0° | 120.0° |
| C04 | C03 | C02 | H15 | 71.7° | 54.0° |
| C04 | C03 | C02 | H16 | 46.8° | 66.1° |
| C03 | C04 | H18 | H19 | 120.0° | 120.0° |
| C03 | C04 | H18 | H20 | 120.0° | 120.0° |
| C03 | C04 | H19 | H20 | 120.0° | 119.9° |
| C04 | C03 | C05 | H21 | 55.2° | 60.0° |
| C04 | C03 | C05 | H22 | 175.2° | 180.0° |
| C04 | C03 | C05 | H23 | 64.8° | 60.0° |
| H1 | C10 | C11 | H3 | 102.7° | 60.1° |
| H1 | C10 | C11 | H4 | 26.9° | 179.9° |
| H1 | C10 | C09 | H33 | 67.6° | 180.0° |
| H1 | C10 | C09 | H34 | 172.9° | 60.1° |
| H1 | C10 | C11 | N1 | 142.1° | 60.0° |
| H2 | C10 | C11 | H3 | 138.5° | 180.0° |
| H2 | C10 | C11 | H4 | 91.9° | 60.0° |
| H2 | C10 | C09 | H33 | 51.2° | 60.0° |
| H2 | C10 | C09 | H34 | 68.3° | 180.0° |
| H2 | C10 | C11 | N1 | 23.3° | 60.0° |
| H3 | C11 | H4 | N1 | 132.6° | 120.0° |
| H3 | C11 | N1 | H5 | 90.0° | 63.9° |
| H3 | C11 | N1 | H35 | 90.0° | 60.0° |
| H4 | C11 | N1 | H5 | 90.0° | 176.1° |
| H4 | C11 | N1 | H35 | 90.0° | 60.0° |
| H6 | C13 | N04 | H28 | 85.5° | 155.0° |
| H7 | C13 | N04 | H28 | 154.2° | 35.0° |
| H10 | C19 | C20 | H11 | 0.7° | 0.1° |
| H10 | C19 | C18 | H30 | 0.7° | 0.4° |
| H11 | C20 | C21 | H12 | 0.5° | 0.0° |
| H13 | N01 | C01 | H14 | 85.2° | 100.1° |
| H14 | C01 | C02 | H15 | 62.3° | 174.8° |
| H14 | C01 | C02 | H16 | 179.1° | 65.2° |
| H15 | C02 | C03 | H17 | 170.6° | 66.0° |
| H16 | C02 | C03 | H17 | 70.8° | 173.9° |
| H17 | C03 | C04 | H18 | 62.3° | 180.0° |
| H17 | C03 | C04 | H19 | 177.6° | 59.9° |
| H17 | C03 | C04 | H20 | 57.7° | 60.0° |
| H17 | C03 | C05 | H21 | 61.8° | 180.0° |
| H17 | C03 | C05 | H22 | 58.2° | 60.1° |
| H17 | C03 | C05 | H23 | 178.3° | 60.0° |
| H18 | C04 | H19 | H20 | 120.0° | 120.0° |
| H21 | C05 | H22 | H23 | 120.0° | 120.0° |
| H24 | N02 | C07 | H25 | 156.1° | 145.1° |
| H25 | C07 | C08 | H31 | 57.7° | 175.0° |
| H25 | C07 | C08 | H32 | 61.5° | 65.0° |
| H29 | C17 | C18 | H30 | 0.5° | 0.3° |
| H31 | C08 | C09 | H33 | 178.2° | 60.0° |
| H31 | C08 | C09 | H34 | 58.7° | 180.0° |
| H32 | C08 | C09 | H33 | 62.6° | 180.0° |
| H32 | C08 | C09 | H34 | 177.9° | 60.0° |
| C11 | N1 | H5 | H35 | 90.0° | 123.9° |
