A1BJB
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O37 | C35 | doub | 1.21Å | 1.25Å | |
| O36 | C35 | sing | 1.35Å | 1.24Å | |
| C35 | C32 | sing | 1.48Å | 1.50Å | |
| C32 | C33 | doub | 1.40Å | 1.38Å | Aromatic |
| C32 | C31 | sing | 1.40Å | 1.37Å | Aromatic |
| C33 | C34 | sing | 1.38Å | 1.38Å | Aromatic |
| C31 | C30 | doub | 1.38Å | 1.36Å | Aromatic |
| C34 | C29 | doub | 1.38Å | 1.38Å | Aromatic |
| C30 | C29 | sing | 1.38Å | 1.36Å | Aromatic |
| C29 | C15 | sing | 1.51Å | 1.52Å | |
| C07 | C06 | doub | 1.38Å | 1.41Å | Aromatic |
| C07 | C08 | sing | 1.38Å | 1.40Å | Aromatic |
| C06 | C05 | sing | 1.39Å | 1.41Å | Aromatic |
| C08 | C09 | doub | 1.39Å | 1.41Å | Aromatic |
| C15 | N16 | sing | 1.47Å | 1.44Å | |
| C15 | C13 | sing | 1.51Å | 1.52Å | |
| N16 | C17 | sing | 1.35Å | 1.43Å | |
| O18 | C17 | doub | 1.22Å | 1.19Å | |
| C17 | N19 | sing | 1.35Å | 1.45Å | |
| C05 | C04 | doub | 1.41Å | 1.37Å | Aromatic |
| C05 | C38 | sing | 1.47Å | 1.51Å | |
| O28 | C27 | doub | 1.21Å | 1.18Å | |
| C09 | C04 | sing | 1.38Å | 1.41Å | Aromatic |
| C09 | C10 | sing | 1.51Å | 1.56Å | |
| N19 | C27 | sing | 1.35Å | 1.32Å | |
| N19 | C20 | sing | 1.46Å | 1.60Å | |
| C13 | O14 | doub | 1.21Å | 1.17Å | |
| C13 | N12 | sing | 1.35Å | 1.44Å | |
| O39 | C38 | doub | 1.22Å | 1.24Å | |
| C27 | C25 | sing | 1.50Å | 1.56Å | |
| C20 | C21 | sing | 1.53Å | 1.33Å | |
| C21 | N22 | sing | 1.46Å | 1.60Å | |
| C04 | O03 | sing | 1.36Å | 1.44Å | |
| C38 | O40 | sing | 1.35Å | 1.26Å | |
| N12 | C11 | sing | 1.47Å | 1.50Å | |
| C10 | C11 | sing | 1.53Å | 1.50Å | |
| C25 | N22 | sing | 1.35Å | 1.32Å | |
| C25 | O26 | doub | 1.21Å | 1.20Å | |
| N22 | C23 | sing | 1.46Å | 1.45Å | |
| C11 | B02 | sing | 1.58Å | 1.61Å | |
| C24 | C23 | sing | 1.53Å | 1.50Å | |
| O03 | B02 | sing | 1.42Å | 1.37Å | |
| O01 | B02 | sing | 1.42Å | 1.38Å | |
| C10 | H1 | sing | 1.09Å | 1.10Å | |
| C10 | H2 | sing | 1.09Å | 1.10Å | |
| N12 | H3 | sing | 0.97Å | 1.00Å | |
| C15 | H4 | sing | 1.09Å | 1.10Å | |
| C20 | H5 | sing | 1.09Å | 1.10Å | |
| C20 | H6 | sing | 1.09Å | 1.10Å | |
| C21 | H7 | sing | 1.09Å | 1.10Å | |
| C21 | H8 | sing | 1.09Å | 1.10Å | |
| C24 | H9 | sing | 1.09Å | 1.10Å | |
| C24 | H10 | sing | 1.09Å | 1.10Å | |
| C24 | H11 | sing | 1.09Å | 1.10Å | |
| O01 | H12 | sing | 0.97Å | 0.95Å | |
| C06 | H13 | sing | 1.08Å | 1.08Å | |
| C07 | H14 | sing | 1.08Å | 1.08Å | |
| C08 | H15 | sing | 1.08Å | 1.08Å | |
| C11 | H16 | sing | 1.09Å | 1.10Å | |
| N16 | H17 | sing | 0.97Å | 1.00Å | |
| C23 | H18 | sing | 1.09Å | 1.10Å | |
| C23 | H19 | sing | 1.09Å | 1.10Å | |
| C30 | H20 | sing | 1.08Å | 1.08Å | |
| C31 | H21 | sing | 1.08Å | 1.08Å | |
| C33 | H22 | sing | 1.08Å | 1.08Å | |
| C34 | H23 | sing | 1.08Å | 1.08Å | |
| O36 | H24 | sing | 0.97Å | 0.95Å | |
| O40 | H25 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O37 | C35 | O36 | 122.3° | 120.0° |
| O37 | C35 | C32 | 120.5° | 120.0° |
| O36 | C35 | C32 | 117.1° | 120.0° |
| C35 | O36 | H24 | 109.5° | 116.9° |
| C35 | C32 | C33 | 122.2° | 120.2° |
| C35 | C32 | C31 | 116.7° | 120.1° |
| C33 | C32 | C31 | 121.1° | 119.7° |
| C32 | C33 | C34 | 118.6° | 119.8° |
| C32 | C33 | H22 | 120.7° | 120.0° |
| C32 | C31 | C30 | 119.7° | 119.8° |
| C32 | C31 | H21 | 120.1° | 120.1° |
| C33 | C34 | C29 | 119.7° | 120.2° |
| C34 | C33 | H22 | 120.7° | 120.1° |
| C33 | C34 | H23 | 120.1° | 119.9° |
| C31 | C30 | C29 | 120.5° | 120.2° |
| C31 | C30 | H20 | 119.8° | 120.0° |
| C30 | C31 | H21 | 120.2° | 120.0° |
| C34 | C29 | C30 | 120.4° | 120.3° |
| C34 | C29 | C15 | 124.1° | 119.8° |
| C29 | C34 | H23 | 120.2° | 119.9° |
| C30 | C29 | C15 | 115.5° | 119.9° |
| C29 | C30 | H20 | 119.7° | 119.9° |
| C29 | C15 | N16 | 117.5° | 109.5° |
| C29 | C15 | C13 | 111.7° | 109.5° |
| C29 | C15 | H4 | 108.0° | 109.5° |
| C06 | C07 | C08 | 120.9° | 120.1° |
| C07 | C06 | C05 | 118.8° | 119.6° |
| C07 | C06 | H13 | 120.6° | 120.2° |
| C06 | C07 | H14 | 119.6° | 119.9° |
| C07 | C08 | C09 | 119.1° | 121.1° |
| C08 | C07 | H14 | 119.6° | 120.0° |
| C07 | C08 | H15 | 120.4° | 119.5° |
| C06 | C05 | C04 | 120.8° | 120.2° |
| C06 | C05 | C38 | 123.1° | 119.9° |
| C05 | C06 | H13 | 120.6° | 120.1° |
| C08 | C09 | C04 | 119.7° | 119.6° |
| C08 | C09 | C10 | 124.4° | 117.0° |
| C09 | C08 | H15 | 120.4° | 119.5° |
| N16 | C15 | C13 | 102.1° | 109.5° |
| C15 | N16 | C17 | 119.9° | 120.0° |
| N16 | C15 | H4 | 109.0° | 109.5° |
| C15 | N16 | H17 | 120.0° | 120.0° |
| C15 | C13 | O14 | 120.0° | 120.0° |
| C15 | C13 | N12 | 119.0° | 120.0° |
| C13 | C15 | H4 | 108.0° | 109.4° |
| N16 | C17 | O18 | 120.3° | 120.0° |
| N16 | C17 | N19 | 117.9° | 120.0° |
| C17 | N16 | H17 | 120.0° | 120.1° |
| O18 | C17 | N19 | 121.7° | 120.0° |
| C17 | N19 | C27 | 125.0° | 119.9° |
| C17 | N19 | C20 | 121.5° | 119.9° |
| C04 | C05 | C38 | 116.1° | 119.9° |
| C05 | C04 | C09 | 120.7° | 119.5° |
| C05 | C04 | O03 | 120.3° | 116.7° |
| C05 | C38 | O39 | 118.8° | 120.0° |
| C05 | C38 | O40 | 119.4° | 120.0° |
| O28 | C27 | N19 | 118.9° | 120.4° |
| O28 | C27 | C25 | 120.3° | 120.5° |
| C04 | C09 | C10 | 115.9° | 123.4° |
| C09 | C04 | O03 | 119.0° | 123.8° |
| C09 | C10 | C11 | 106.8° | 110.4° |
| C09 | C10 | H1 | 110.1° | 109.3° |
| C09 | C10 | H2 | 110.1° | 109.2° |
| C27 | N19 | C20 | 113.5° | 120.1° |
| N19 | C27 | C25 | 120.6° | 119.1° |
| N19 | C20 | C21 | 113.7° | 110.6° |
| N19 | C20 | H5 | 108.4° | 109.3° |
| N19 | C20 | H6 | 108.4° | 109.2° |
| O14 | C13 | N12 | 121.0° | 120.0° |
| C13 | N12 | C11 | 123.7° | 120.0° |
| C13 | N12 | H3 | 118.1° | 120.0° |
| O39 | C38 | O40 | 121.8° | 120.0° |
| C27 | C25 | N22 | 121.1° | 119.1° |
| C27 | C25 | O26 | 119.7° | 120.5° |
| C20 | C21 | N22 | 116.9° | 110.5° |
| C21 | C20 | H5 | 108.4° | 109.2° |
| C21 | C20 | H6 | 108.4° | 109.2° |
| C20 | C21 | H7 | 107.6° | 109.3° |
| C20 | C21 | H8 | 107.6° | 109.3° |
| C21 | N22 | C25 | 110.4° | 120.2° |
| C21 | N22 | C23 | 127.4° | 119.9° |
| N22 | C21 | H7 | 107.6° | 109.3° |
| N22 | C21 | H8 | 107.6° | 109.3° |
| C04 | O03 | B02 | 111.9° | 114.9° |
| C38 | O40 | H25 | 109.5° | 117.0° |
| N12 | C11 | C10 | 103.8° | 110.0° |
| N12 | C11 | B02 | 111.8° | 109.9° |
| C11 | N12 | H3 | 118.1° | 120.0° |
| N12 | C11 | H16 | 109.8° | 110.0° |
| C10 | C11 | B02 | 113.3° | 106.8° |
| C11 | C10 | H1 | 110.2° | 109.3° |
| C11 | C10 | H2 | 110.1° | 109.3° |
| C10 | C11 | H16 | 109.7° | 110.0° |
| N22 | C25 | O26 | 119.2° | 120.4° |
| C25 | N22 | C23 | 122.2° | 119.9° |
| N22 | C23 | C24 | 113.0° | 109.5° |
| N22 | C23 | H18 | 108.6° | 109.5° |
| N22 | C23 | H19 | 108.6° | 109.4° |
| C11 | B02 | O03 | 115.1° | 116.4° |
| C11 | B02 | O01 | 113.2° | 121.8° |
| B02 | C11 | H16 | 108.4° | 110.1° |
| C23 | C24 | H9 | 109.5° | 109.5° |
| C23 | C24 | H10 | 109.5° | 109.4° |
| C23 | C24 | H11 | 109.5° | 109.4° |
| C24 | C23 | H18 | 108.6° | 109.5° |
| C24 | C23 | H19 | 108.6° | 109.4° |
| O03 | B02 | O01 | 111.3° | 121.8° |
| B02 | O01 | H12 | 109.5° | 114.0° |
| H1 | C10 | H2 | 109.5° | 109.3° |
| H5 | C20 | H6 | 109.5° | 109.2° |
| H7 | C21 | H8 | 109.5° | 109.2° |
| H9 | C24 | H10 | 109.5° | 109.5° |
| H9 | C24 | H11 | 109.5° | 109.5° |
| H10 | C24 | H11 | 109.5° | 109.4° |
| H18 | C23 | H19 | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O37 | C35 | O36 | C32 | 178.4° | 180.0° |
| O37 | C35 | C32 | C33 | 108.0° | 0.1° |
| O37 | C35 | C32 | C31 | 71.6° | 179.7° |
| O37 | C35 | O36 | H24 | 0.0° | 0.0° |
| O36 | C35 | C32 | C33 | 73.6° | 180.0° |
| O36 | C35 | C32 | C31 | 106.9° | 0.3° |
| C35 | C32 | C33 | C31 | 179.5° | 179.8° |
| C35 | C32 | C33 | C34 | 179.6° | 180.0° |
| C35 | C32 | C31 | C30 | 179.4° | 179.7° |
| C35 | C32 | C31 | H21 | 0.6° | 0.2° |
| C35 | C32 | C33 | H22 | 0.4° | 0.2° |
| C32 | C35 | O36 | H24 | 178.4° | 180.0° |
| C32 | C33 | C34 | H22 | 180.0° | 179.8° |
| C33 | C32 | C31 | C30 | 0.1° | 0.1° |
| C32 | C33 | C34 | C29 | 0.4° | 0.5° |
| C33 | C32 | C31 | H21 | 179.9° | 180.0° |
| C32 | C33 | C34 | H23 | 179.6° | 179.9° |
| C31 | C32 | C33 | C34 | 0.0° | 0.2° |
| C32 | C31 | C30 | H21 | 180.0° | 179.9° |
| C32 | C31 | C30 | C29 | 0.7° | 0.0° |
| C32 | C31 | C30 | H20 | 179.3° | 179.9° |
| C31 | C32 | C33 | H22 | 180.0° | 180.0° |
| C33 | C34 | C29 | H23 | 180.0° | 179.4° |
| C33 | C34 | C29 | C30 | 1.0° | 0.6° |
| C33 | C34 | C29 | C15 | 179.9° | 179.8° |
| C31 | C30 | C29 | C34 | 1.1° | 0.3° |
| C31 | C30 | C29 | H20 | 180.0° | 180.0° |
| C31 | C30 | C29 | C15 | 179.8° | 180.0° |
| C34 | C29 | C30 | C15 | 179.0° | 179.7° |
| C34 | C29 | C15 | N16 | 28.5° | 40.3° |
| C34 | C29 | C15 | C13 | 89.0° | 79.7° |
| C34 | C29 | C15 | H4 | 152.4° | 160.3° |
| C34 | C29 | C30 | H20 | 178.9° | 179.7° |
| C29 | C34 | C33 | H22 | 179.6° | 179.7° |
| C30 | C29 | C15 | N16 | 150.5° | 140.0° |
| C30 | C29 | C15 | C13 | 92.0° | 100.0° |
| C30 | C29 | C15 | H4 | 26.6° | 20.0° |
| C29 | C30 | C31 | H21 | 179.3° | 179.9° |
| C30 | C29 | C34 | H23 | 179.0° | 180.0° |
| C29 | C15 | N16 | C13 | 122.6° | 120.1° |
| C29 | C15 | N16 | H4 | 123.3° | 120.0° |
| C29 | C15 | C13 | H4 | 118.7° | 120.0° |
| C29 | C15 | N16 | C17 | 106.3° | 85.0° |
| C29 | C15 | C13 | O14 | 94.5° | 120.0° |
| C29 | C15 | C13 | N12 | 88.8° | 60.0° |
| C29 | C15 | N16 | H17 | 73.7° | 95.0° |
| C15 | C29 | C30 | H20 | 0.2° | 0.1° |
| C15 | C29 | C34 | H23 | 0.1° | 0.3° |
| C06 | C07 | C08 | H14 | 180.0° | 179.9° |
| C07 | C06 | C05 | H13 | 180.0° | 180.0° |
| C06 | C07 | C08 | C09 | 1.2° | 0.0° |
| C07 | C06 | C05 | C04 | 0.9° | 0.1° |
| C07 | C06 | C05 | C38 | 179.2° | 179.9° |
| C06 | C07 | C08 | H15 | 178.7° | 180.0° |
| C08 | C07 | C06 | C05 | 0.1° | 0.3° |
| C07 | C08 | C09 | H15 | 180.0° | 180.0° |
| C07 | C08 | C09 | C04 | 1.7° | 0.7° |
| C07 | C08 | C09 | C10 | 178.9° | 178.5° |
| C08 | C07 | C06 | H13 | 179.9° | 179.7° |
| C06 | C05 | C04 | C38 | 179.9° | 180.0° |
| C06 | C05 | C04 | C09 | 0.5° | 0.6° |
| C06 | C05 | C38 | O39 | 44.4° | 180.0° |
| C06 | C05 | C04 | O03 | 178.4° | 179.3° |
| C06 | C05 | C38 | O40 | 135.4° | 0.0° |
| C05 | C06 | C07 | H14 | 179.9° | 179.7° |
| C08 | C09 | C04 | C05 | 0.8° | 1.0° |
| C08 | C09 | C04 | C10 | 179.5° | 179.2° |
| C08 | C09 | C04 | O03 | 177.1° | 179.0° |
| C08 | C09 | C10 | C11 | 131.9° | 160.2° |
| C08 | C09 | C10 | H1 | 12.3° | 79.5° |
| C08 | C09 | C10 | H2 | 108.5° | 40.0° |
| C09 | C08 | C07 | H14 | 178.8° | 179.9° |
| N16 | C15 | C13 | H4 | 114.9° | 119.9° |
| C15 | N16 | C17 | H17 | 180.0° | 179.9° |
| C15 | N16 | C17 | O18 | 4.4° | 5.1° |
| C15 | N16 | C17 | N19 | 177.3° | 174.9° |
| N16 | C15 | C13 | O14 | 31.9° | 0.1° |
| N16 | C15 | C13 | N12 | 144.7° | 180.0° |
| C13 | C15 | N16 | C17 | 131.2° | 155.0° |
| C15 | C13 | O14 | N12 | 176.6° | 180.0° |
| C15 | C13 | N12 | C11 | 179.6° | 179.9° |
| C15 | C13 | N12 | H3 | 0.4° | 0.0° |
| C13 | C15 | N16 | H17 | 48.9° | 25.1° |
| N16 | C17 | O18 | N19 | 178.3° | 180.0° |
| N16 | C17 | N19 | C27 | 1.8° | 175.1° |
| N16 | C17 | N19 | C20 | 179.7° | 4.8° |
| C17 | N16 | C15 | H4 | 17.0° | 35.1° |
| O18 | C17 | N19 | C27 | 179.9° | 4.9° |
| O18 | C17 | N19 | C20 | 1.4° | 175.1° |
| O18 | C17 | N16 | H17 | 175.6° | 174.8° |
| C17 | N19 | C27 | O28 | 19.4° | 6.0° |
| C17 | N19 | C27 | C20 | 178.6° | 179.9° |
| C17 | N19 | C27 | C25 | 155.6° | 174.0° |
| C17 | N19 | C20 | C21 | 164.7° | 142.4° |
| C17 | N19 | C20 | H5 | 74.7° | 22.2° |
| C17 | N19 | C20 | H6 | 44.1° | 97.3° |
| N19 | C17 | N16 | H17 | 2.7° | 5.1° |
| C05 | C04 | C09 | O03 | 177.9° | 179.9° |
| C05 | C04 | C09 | C10 | 179.7° | 178.2° |
| C04 | C05 | C38 | O39 | 135.7° | 0.1° |
| C04 | C05 | C38 | O40 | 44.5° | 180.0° |
| C05 | C04 | O03 | B02 | 130.0° | 168.7° |
| C04 | C05 | C06 | H13 | 179.1° | 180.0° |
| C38 | C05 | C04 | C09 | 179.6° | 179.4° |
| C05 | C38 | O39 | O40 | 179.7° | 179.9° |
| C38 | C05 | C04 | O03 | 1.7° | 0.6° |
| C38 | C05 | C06 | H13 | 0.8° | 0.0° |
| C05 | C38 | O40 | H25 | 179.7° | 180.0° |
| O28 | C27 | N19 | C25 | 175.0° | 180.0° |
| O28 | C27 | N19 | C20 | 162.0° | 174.0° |
| O28 | C27 | C25 | N22 | 154.4° | 168.2° |
| O28 | C27 | C25 | O26 | 27.7° | 11.8° |
| C04 | C09 | C10 | C11 | 47.5° | 20.6° |
| C09 | C04 | O03 | B02 | 47.9° | 11.4° |
| C04 | C09 | C10 | H1 | 167.1° | 99.7° |
| C04 | C09 | C10 | H2 | 72.1° | 140.8° |
| C04 | C09 | C08 | H15 | 178.3° | 179.3° |
| C10 | C09 | C04 | O03 | 2.4° | 1.9° |
| C09 | C10 | C11 | N12 | 76.8° | 162.6° |
| C09 | C10 | C11 | H1 | 119.6° | 120.3° |
| C09 | C10 | C11 | H2 | 119.6° | 120.1° |
| C09 | C10 | C11 | B02 | 44.6° | 43.3° |
| C09 | C10 | H1 | H2 | 121.2° | 119.5° |
| C10 | C09 | C08 | H15 | 1.1° | 1.4° |
| C09 | C10 | C11 | H16 | 165.9° | 76.1° |
| C27 | N19 | C20 | C21 | 16.7° | 37.5° |
| N19 | C27 | C25 | N22 | 30.7° | 11.8° |
| N19 | C27 | C25 | O26 | 147.2° | 168.2° |
| C27 | N19 | C20 | H5 | 103.9° | 157.8° |
| C27 | N19 | C20 | H6 | 137.3° | 82.7° |
| C20 | N19 | C27 | C25 | 23.0° | 6.0° |
| N19 | C20 | C21 | H5 | 120.6° | 120.3° |
| N19 | C20 | C21 | H6 | 120.6° | 120.3° |
| N19 | C20 | C21 | N22 | 50.8° | 51.6° |
| N19 | C20 | H5 | H6 | 118.1° | 119.5° |
| N19 | C20 | C21 | H7 | 171.9° | 171.8° |
| N19 | C20 | C21 | H8 | 70.2° | 68.7° |
| O14 | C13 | N12 | C11 | 3.7° | 0.0° |
| O14 | C13 | N12 | H3 | 176.2° | 180.0° |
| O14 | C13 | C15 | H4 | 146.8° | 120.0° |
| C13 | N12 | C11 | H3 | 180.0° | 179.9° |
| C13 | N12 | C11 | C10 | 67.2° | 135.0° |
| C13 | N12 | C11 | B02 | 170.4° | 107.6° |
| N12 | C13 | C15 | H4 | 29.9° | 60.0° |
| C13 | N12 | C11 | H16 | 50.1° | 13.8° |
| O39 | C38 | O40 | H25 | 0.0° | 0.1° |
| C27 | C25 | N22 | C21 | 2.4° | 6.0° |
| C27 | C25 | N22 | O26 | 177.9° | 180.0° |
| C27 | C25 | N22 | C23 | 177.9° | 174.0° |
| C20 | C21 | N22 | H7 | 121.1° | 120.3° |
| C20 | C21 | N22 | H8 | 121.1° | 120.3° |
| C20 | C21 | N22 | C25 | 43.6° | 37.5° |
| C20 | C21 | N22 | C23 | 136.7° | 142.5° |
| C21 | C20 | H5 | H6 | 118.1° | 119.5° |
| C20 | C21 | H7 | H8 | 116.6° | 119.5° |
| C21 | N22 | C25 | C23 | 179.7° | 180.0° |
| C21 | N22 | C25 | O26 | 179.7° | 174.0° |
| C21 | N22 | C23 | C24 | 25.3° | 90.0° |
| N22 | C21 | C20 | H5 | 69.8° | 171.8° |
| N22 | C21 | C20 | H6 | 171.4° | 68.7° |
| N22 | C21 | H7 | H8 | 116.6° | 119.5° |
| C21 | N22 | C23 | H18 | 145.8° | 30.0° |
| C21 | N22 | C23 | H19 | 95.3° | 150.0° |
| C04 | O03 | B02 | C11 | 47.6° | 40.3° |
| C04 | O03 | B02 | O01 | 82.9° | 139.8° |
| N12 | C11 | C10 | B02 | 121.4° | 119.3° |
| N12 | C11 | C10 | H16 | 117.3° | 121.3° |
| N12 | C11 | B02 | H16 | 121.1° | 121.3° |
| N12 | C11 | B02 | O03 | 117.3° | 176.5° |
| N12 | C11 | B02 | O01 | 12.3° | 3.5° |
| N12 | C11 | C10 | H1 | 42.7° | 42.3° |
| N12 | C11 | C10 | H2 | 163.6° | 77.3° |
| C10 | C11 | B02 | H16 | 122.0° | 119.4° |
| C10 | C11 | B02 | O03 | 0.4° | 57.2° |
| C10 | C11 | B02 | O01 | 129.1° | 122.9° |
| C11 | C10 | H1 | H2 | 121.3° | 119.6° |
| C10 | C11 | N12 | H3 | 112.8° | 44.9° |
| C25 | N22 | C23 | C24 | 154.4° | 90.0° |
| C25 | N22 | C21 | H7 | 164.6° | 157.8° |
| C25 | N22 | C21 | H8 | 77.5° | 82.8° |
| C25 | N22 | C23 | H18 | 33.8° | 150.0° |
| C25 | N22 | C23 | H19 | 85.1° | 30.0° |
| O26 | C25 | N22 | C23 | 0.1° | 6.0° |
| N22 | C23 | C24 | H18 | 120.5° | 120.1° |
| N22 | C23 | C24 | H19 | 120.5° | 120.0° |
| C23 | N22 | C21 | H7 | 15.6° | 22.2° |
| C23 | N22 | C21 | H8 | 102.2° | 97.2° |
| N22 | C23 | C24 | H9 | 180.0° | 180.0° |
| N22 | C23 | C24 | H10 | 60.0° | 60.0° |
| N22 | C23 | C24 | H11 | 60.0° | 59.9° |
| N22 | C23 | H18 | H19 | 118.4° | 120.0° |
| C11 | B02 | O03 | O01 | 130.5° | 179.9° |
| B02 | C11 | C10 | H1 | 164.2° | 77.0° |
| B02 | C11 | C10 | H2 | 75.0° | 163.4° |
| B02 | C11 | N12 | H3 | 9.6° | 72.4° |
| C11 | B02 | O01 | H12 | 131.5° | 180.0° |
| C23 | C24 | H9 | H10 | 120.0° | 120.0° |
| C23 | C24 | H9 | H11 | 120.0° | 120.0° |
| C23 | C24 | H10 | H11 | 120.0° | 119.9° |
| C24 | C23 | H18 | H19 | 118.4° | 120.0° |
| O03 | B02 | O01 | H12 | 0.0° | 0.0° |
| O03 | B02 | C11 | H16 | 121.6° | 62.2° |
| O01 | B02 | C11 | H16 | 108.8° | 117.8° |
| H1 | C10 | C11 | H16 | 74.6° | 163.6° |
| H2 | C10 | C11 | H16 | 46.3° | 43.9° |
| H3 | N12 | C11 | H16 | 129.9° | 166.2° |
| H4 | C15 | N16 | H17 | 163.0° | 145.0° |
| H5 | C20 | C21 | H7 | 51.3° | 67.9° |
| H5 | C20 | C21 | H8 | 169.1° | 51.6° |
| H6 | C20 | C21 | H7 | 67.5° | 51.6° |
| H6 | C20 | C21 | H8 | 50.4° | 171.0° |
| H9 | C24 | H10 | H11 | 120.0° | 120.1° |
| H9 | C24 | C23 | H18 | 59.5° | 59.9° |
| H9 | C24 | C23 | H19 | 59.5° | 60.0° |
| H10 | C24 | C23 | H18 | 179.5° | 60.1° |
| H10 | C24 | C23 | H19 | 60.6° | 179.9° |
| H11 | C24 | C23 | H18 | 60.5° | 180.0° |
| H11 | C24 | C23 | H19 | 179.5° | 60.0° |
| H13 | C06 | C07 | H14 | 0.0° | 0.2° |
| H14 | C07 | C08 | H15 | 1.3° | 0.1° |
| H20 | C30 | C31 | H21 | 0.7° | 0.0° |
| H22 | C33 | C34 | H23 | 0.4° | 0.3° |
