TZX
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C27 | C28 | sing | 1.53Å | 1.57Å | |
| C27 | N26 | sing | 1.47Å | 1.52Å | |
| C28 | N29 | sing | 1.47Å | 1.46Å | |
| N26 | C25 | sing | 1.40Å | 1.49Å | |
| N26 | C31 | sing | 1.47Å | 1.51Å | |
| N29 | C30 | sing | 1.47Å | 1.46Å | |
| C32 | C25 | doub | 1.39Å | 1.43Å | Aromatic |
| C32 | C21 | sing | 1.38Å | 1.45Å | Aromatic |
| C30 | C31 | sing | 1.53Å | 1.55Å | |
| C25 | C24 | sing | 1.39Å | 1.42Å | Aromatic |
| O20 | C21 | sing | 1.36Å | 1.41Å | |
| O20 | C19 | sing | 1.42Å | 1.45Å | |
| C21 | C22 | doub | 1.40Å | 1.37Å | Aromatic |
| C24 | C23 | doub | 1.38Å | 1.42Å | Aromatic |
| C22 | C23 | sing | 1.39Å | 1.41Å | Aromatic |
| C22 | C16 | sing | 1.48Å | 1.51Å | |
| C15 | C16 | doub | 1.39Å | 1.42Å | Aromatic |
| C15 | N14 | sing | 1.32Å | 1.37Å | Aromatic |
| C16 | C17 | sing | 1.40Å | 1.40Å | Aromatic |
| C19 | C18 | sing | 1.53Å | 1.57Å | |
| N14 | C13 | doub | 1.32Å | 1.36Å | Aromatic |
| C17 | C18 | sing | 1.50Å | 1.51Å | |
| C17 | C12 | doub | 1.39Å | 1.46Å | Aromatic |
| C13 | C12 | sing | 1.40Å | 1.41Å | Aromatic |
| C09 | O08 | sing | 1.43Å | 1.42Å | |
| C12 | C11 | sing | 1.48Å | 1.54Å | |
| C10 | C11 | doub | 1.39Å | 1.41Å | Aromatic |
| C10 | C07 | sing | 1.38Å | 1.42Å | Aromatic |
| O08 | C07 | sing | 1.36Å | 1.40Å | |
| C11 | C33 | sing | 1.39Å | 1.43Å | Aromatic |
| C07 | C04 | doub | 1.39Å | 1.39Å | Aromatic |
| C33 | C03 | doub | 1.38Å | 1.43Å | Aromatic |
| C04 | C03 | sing | 1.39Å | 1.38Å | Aromatic |
| C04 | O05 | sing | 1.36Å | 1.42Å | |
| C06 | O05 | sing | 1.43Å | 1.40Å | |
| C03 | O02 | sing | 1.36Å | 1.41Å | |
| O02 | C01 | sing | 1.43Å | 1.41Å | |
| C10 | H1 | sing | 1.08Å | 1.08Å | |
| C06 | H2 | sing | 1.09Å | 1.10Å | |
| C06 | H3 | sing | 1.09Å | 1.10Å | |
| C06 | H4 | sing | 1.09Å | 1.10Å | |
| C09 | H5 | sing | 1.09Å | 1.10Å | |
| C09 | H6 | sing | 1.09Å | 1.10Å | |
| C09 | H7 | sing | 1.09Å | 1.10Å | |
| C01 | H8 | sing | 1.09Å | 1.10Å | |
| C01 | H9 | sing | 1.09Å | 1.10Å | |
| C01 | H10 | sing | 1.09Å | 1.10Å | |
| C13 | H11 | sing | 1.08Å | 1.08Å | |
| C15 | H12 | sing | 1.08Å | 1.08Å | |
| C18 | H13 | sing | 1.09Å | 1.10Å | |
| C18 | H14 | sing | 1.09Å | 1.10Å | |
| C19 | H15 | sing | 1.09Å | 1.10Å | |
| C19 | H16 | sing | 1.09Å | 1.10Å | |
| C23 | H17 | sing | 1.08Å | 1.08Å | |
| C24 | H18 | sing | 1.08Å | 1.08Å | |
| C27 | H19 | sing | 1.09Å | 1.10Å | |
| C27 | H20 | sing | 1.09Å | 1.10Å | |
| C28 | H21 | sing | 1.09Å | 1.10Å | |
| C28 | H22 | sing | 1.09Å | 1.10Å | |
| C30 | H23 | sing | 1.09Å | 1.10Å | |
| C30 | H24 | sing | 1.09Å | 1.10Å | |
| C31 | H25 | sing | 1.09Å | 1.10Å | |
| C31 | H26 | sing | 1.09Å | 1.10Å | |
| C32 | H27 | sing | 1.08Å | 1.08Å | |
| C33 | H28 | sing | 1.08Å | 1.08Å | |
| N29 | H29 | sing | 1.01Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C28 | C27 | N26 | 116.0° | 109.4° |
| C27 | C28 | N29 | 115.0° | 109.3° |
| C28 | C27 | H19 | 107.8° | 109.5° |
| C28 | C27 | H20 | 107.8° | 109.4° |
| C27 | C28 | H21 | 108.1° | 109.5° |
| C27 | C28 | H22 | 108.1° | 109.5° |
| C27 | N26 | C25 | 121.1° | 111.0° |
| C27 | N26 | C31 | 107.1° | 110.8° |
| N26 | C27 | H19 | 107.8° | 109.5° |
| N26 | C27 | H20 | 107.8° | 109.5° |
| C28 | N29 | C30 | 110.0° | 110.9° |
| N29 | C28 | H21 | 108.0° | 109.5° |
| N29 | C28 | H22 | 108.1° | 109.5° |
| C28 | N29 | H29 | 109.3° | 111.0° |
| C25 | N26 | C31 | 124.0° | 111.0° |
| N26 | C25 | C32 | 124.4° | 120.0° |
| N26 | C25 | C24 | 121.9° | 119.9° |
| N26 | C31 | C30 | 116.1° | 109.4° |
| N26 | C31 | H25 | 107.8° | 109.5° |
| N26 | C31 | H26 | 107.8° | 109.5° |
| N29 | C30 | C31 | 112.5° | 109.4° |
| N29 | C30 | H23 | 108.7° | 109.5° |
| N29 | C30 | H24 | 108.7° | 109.5° |
| C30 | N29 | H29 | 109.3° | 111.0° |
| C25 | C32 | C21 | 121.8° | 120.0° |
| C32 | C25 | C24 | 113.7° | 120.1° |
| C25 | C32 | H27 | 119.1° | 120.0° |
| C32 | C21 | O20 | 115.9° | 121.1° |
| C32 | C21 | C22 | 124.2° | 119.7° |
| C21 | C32 | H27 | 119.1° | 119.9° |
| C31 | C30 | H23 | 108.7° | 109.5° |
| C31 | C30 | H24 | 108.7° | 109.5° |
| C30 | C31 | H25 | 107.8° | 109.5° |
| C30 | C31 | H26 | 107.8° | 109.5° |
| C25 | C24 | C23 | 122.2° | 120.2° |
| C25 | C24 | H18 | 118.9° | 119.9° |
| C21 | O20 | C19 | 118.2° | 118.2° |
| O20 | C21 | C22 | 119.9° | 119.2° |
| O20 | C19 | C18 | 120.9° | 111.6° |
| O20 | C19 | H15 | 106.6° | 109.1° |
| O20 | C19 | H16 | 106.5° | 109.0° |
| C21 | C22 | C23 | 113.6° | 120.1° |
| C21 | C22 | C16 | 125.3° | 118.7° |
| C24 | C23 | C22 | 124.4° | 119.8° |
| C24 | C23 | H17 | 117.8° | 120.2° |
| C23 | C24 | H18 | 118.9° | 119.9° |
| C23 | C22 | C16 | 121.0° | 121.2° |
| C22 | C23 | H17 | 117.8° | 120.0° |
| C22 | C16 | C15 | 114.7° | 121.9° |
| C22 | C16 | C17 | 128.8° | 119.0° |
| C16 | C15 | N14 | 122.7° | 120.5° |
| C15 | C16 | C17 | 116.5° | 119.1° |
| C16 | C15 | H12 | 118.7° | 119.8° |
| C15 | N14 | C13 | 118.4° | 122.3° |
| N14 | C15 | H12 | 118.6° | 119.7° |
| C16 | C17 | C18 | 118.4° | 119.4° |
| C16 | C17 | C12 | 123.2° | 118.6° |
| C19 | C18 | C17 | 120.1° | 110.2° |
| C19 | C18 | H13 | 106.8° | 109.3° |
| C19 | C18 | H14 | 106.8° | 109.2° |
| C18 | C19 | H15 | 106.5° | 109.0° |
| C18 | C19 | H16 | 106.6° | 109.0° |
| N14 | C13 | C12 | 125.9° | 120.9° |
| N14 | C13 | H11 | 117.1° | 119.5° |
| C18 | C17 | C12 | 118.3° | 122.0° |
| C17 | C18 | H13 | 106.7° | 109.4° |
| C17 | C18 | H14 | 106.7° | 109.4° |
| C17 | C12 | C13 | 113.3° | 118.6° |
| C17 | C12 | C11 | 126.9° | 120.7° |
| C13 | C12 | C11 | 119.8° | 120.7° |
| C12 | C13 | H11 | 117.1° | 119.6° |
| C09 | O08 | C07 | 118.2° | 117.0° |
| O08 | C09 | H5 | 109.5° | 109.5° |
| O08 | C09 | H6 | 109.5° | 109.5° |
| O08 | C09 | H7 | 109.5° | 109.5° |
| C12 | C11 | C10 | 124.3° | 120.0° |
| C12 | C11 | C33 | 121.1° | 120.0° |
| C11 | C10 | C07 | 124.1° | 119.9° |
| C10 | C11 | C33 | 114.5° | 120.0° |
| C11 | C10 | H1 | 117.9° | 120.0° |
| C10 | C07 | O08 | 118.1° | 120.0° |
| C10 | C07 | C04 | 119.5° | 120.0° |
| C07 | C10 | H1 | 117.9° | 120.0° |
| O08 | C07 | C04 | 122.4° | 120.0° |
| C11 | C33 | C03 | 121.0° | 120.0° |
| C11 | C33 | H28 | 119.5° | 120.0° |
| C07 | C04 | C03 | 118.5° | 120.1° |
| C07 | C04 | O05 | 120.2° | 120.0° |
| C33 | C03 | C04 | 122.2° | 120.0° |
| C33 | C03 | O02 | 117.4° | 120.0° |
| C03 | C33 | H28 | 119.5° | 120.0° |
| C03 | C04 | O05 | 121.3° | 120.0° |
| C04 | C03 | O02 | 120.4° | 120.0° |
| C04 | O05 | C06 | 117.5° | 117.0° |
| O05 | C06 | H2 | 109.5° | 109.5° |
| O05 | C06 | H3 | 109.5° | 109.4° |
| O05 | C06 | H4 | 109.5° | 109.5° |
| C03 | O02 | C01 | 117.9° | 117.0° |
| O02 | C01 | H8 | 109.5° | 109.4° |
| O02 | C01 | H9 | 109.5° | 109.5° |
| O02 | C01 | H10 | 109.5° | 109.5° |
| H2 | C06 | H3 | 109.4° | 109.5° |
| H2 | C06 | H4 | 109.5° | 109.5° |
| H3 | C06 | H4 | 109.5° | 109.5° |
| H5 | C09 | H6 | 109.5° | 109.5° |
| H5 | C09 | H7 | 109.4° | 109.5° |
| H6 | C09 | H7 | 109.5° | 109.5° |
| H8 | C01 | H9 | 109.5° | 109.5° |
| H8 | C01 | H10 | 109.5° | 109.5° |
| H9 | C01 | H10 | 109.5° | 109.5° |
| H13 | C18 | H14 | 109.5° | 109.3° |
| H15 | C19 | H16 | 109.5° | 109.1° |
| H19 | C27 | H20 | 109.4° | 109.5° |
| H21 | C28 | H22 | 109.5° | 109.5° |
| H23 | C30 | H24 | 109.5° | 109.5° |
| H25 | C31 | H26 | 109.4° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C28 | C27 | N26 | H19 | 121.0° | 120.0° |
| C28 | C27 | N26 | H20 | 120.9° | 119.9° |
| C27 | C28 | N29 | H21 | 120.8° | 120.0° |
| C27 | C28 | N29 | H22 | 120.8° | 120.0° |
| C28 | C27 | N26 | C25 | 101.4° | 176.8° |
| C28 | C27 | N26 | C31 | 49.1° | 59.3° |
| C27 | C28 | N29 | C30 | 14.9° | 59.3° |
| C28 | C27 | H19 | H20 | 117.0° | 120.0° |
| C27 | C28 | H21 | H22 | 117.5° | 120.1° |
| C27 | C28 | N29 | H29 | 134.9° | 176.8° |
| N26 | C27 | C28 | N29 | 41.5° | 58.4° |
| C27 | N26 | C25 | C31 | 145.4° | 123.8° |
| C27 | N26 | C25 | C32 | 30.4° | 180.0° |
| C27 | N26 | C31 | C30 | 5.0° | 59.3° |
| C27 | N26 | C25 | C24 | 149.3° | 0.0° |
| N26 | C27 | H19 | H20 | 117.0° | 120.1° |
| N26 | C27 | C28 | H21 | 162.3° | 61.5° |
| N26 | C27 | C28 | H22 | 79.3° | 178.3° |
| C27 | N26 | C31 | H25 | 126.0° | 179.3° |
| C27 | N26 | C31 | H26 | 116.0° | 60.7° |
| C28 | N29 | C30 | H29 | 120.1° | 123.9° |
| C28 | N29 | C30 | C31 | 59.1° | 59.3° |
| N29 | C28 | C27 | H19 | 162.5° | 61.6° |
| N29 | C28 | C27 | H20 | 79.5° | 178.4° |
| N29 | C28 | H21 | H22 | 117.4° | 120.0° |
| C28 | N29 | C30 | H23 | 61.3° | 179.2° |
| C28 | N29 | C30 | H24 | 179.6° | 60.7° |
| N26 | C25 | C32 | C24 | 179.7° | 180.0° |
| N26 | C25 | C32 | C21 | 180.0° | 180.0° |
| C25 | N26 | C31 | C30 | 144.4° | 176.8° |
| N26 | C25 | C24 | C23 | 179.9° | 180.0° |
| N26 | C25 | C24 | H18 | 0.1° | 0.0° |
| C25 | N26 | C27 | H19 | 19.6° | 63.2° |
| C25 | N26 | C27 | H20 | 137.7° | 56.9° |
| C25 | N26 | C31 | H25 | 23.4° | 56.9° |
| C25 | N26 | C31 | H26 | 94.6° | 63.2° |
| N26 | C25 | C32 | H27 | 0.0° | 0.1° |
| N26 | C31 | C30 | N29 | 50.3° | 58.4° |
| C31 | N26 | C25 | C32 | 115.0° | 56.3° |
| N26 | C31 | C30 | H25 | 121.0° | 119.9° |
| N26 | C31 | C30 | H26 | 121.0° | 120.0° |
| C31 | N26 | C25 | C24 | 65.3° | 123.8° |
| C31 | N26 | C27 | H19 | 170.1° | 60.7° |
| C31 | N26 | C27 | H20 | 71.8° | 179.3° |
| N26 | C31 | C30 | H23 | 70.1° | 178.4° |
| N26 | C31 | C30 | H24 | 170.7° | 61.6° |
| N26 | C31 | H25 | H26 | 117.0° | 120.1° |
| N29 | C30 | C31 | H23 | 120.4° | 119.9° |
| N29 | C30 | C31 | H24 | 120.4° | 120.0° |
| C30 | N29 | C28 | H21 | 106.0° | 60.7° |
| C30 | N29 | C28 | H22 | 135.7° | 179.3° |
| N29 | C30 | H23 | H24 | 118.6° | 120.1° |
| N29 | C30 | C31 | H25 | 70.7° | 178.4° |
| N29 | C30 | C31 | H26 | 171.3° | 61.6° |
| C25 | C32 | C21 | H27 | 180.0° | 179.9° |
| C25 | C32 | C21 | O20 | 179.8° | 179.4° |
| C25 | C32 | C21 | C22 | 0.6° | 0.0° |
| C32 | C25 | C24 | C23 | 0.2° | 0.1° |
| C32 | C25 | C24 | H18 | 179.8° | 179.9° |
| C21 | C32 | C25 | C24 | 0.3° | 0.0° |
| C32 | C21 | O20 | C22 | 179.2° | 179.5° |
| C32 | C21 | O20 | C19 | 116.7° | 104.1° |
| C32 | C21 | C22 | C23 | 0.7° | 0.1° |
| C32 | C21 | C22 | C16 | 179.8° | 179.7° |
| C31 | C30 | H23 | H24 | 118.7° | 120.0° |
| C30 | C31 | H25 | H26 | 117.0° | 120.0° |
| C31 | C30 | N29 | H29 | 179.2° | 176.8° |
| C25 | C24 | C23 | H18 | 180.0° | 180.0° |
| C25 | C24 | C23 | C22 | 0.4° | 0.0° |
| C25 | C24 | C23 | H17 | 179.6° | 179.9° |
| C24 | C25 | C32 | H27 | 179.7° | 180.0° |
| O20 | C21 | C22 | C23 | 179.8° | 179.4° |
| O20 | C21 | C22 | C16 | 1.2° | 0.8° |
| C21 | O20 | C19 | C18 | 54.1° | 45.1° |
| C21 | O20 | C19 | H15 | 67.5° | 75.4° |
| C21 | O20 | C19 | H16 | 175.7° | 165.6° |
| O20 | C21 | C32 | H27 | 0.2° | 0.6° |
| C19 | O20 | C21 | C22 | 64.1° | 76.4° |
| O20 | C19 | C18 | H15 | 121.6° | 120.6° |
| O20 | C19 | C18 | H16 | 121.6° | 120.5° |
| O20 | C19 | C18 | C17 | 18.1° | 44.8° |
| O20 | C19 | C18 | H13 | 103.4° | 75.4° |
| O20 | C19 | C18 | H14 | 139.6° | 165.0° |
| O20 | C19 | H15 | H16 | 114.8° | 119.0° |
| C21 | C22 | C23 | C24 | 0.6° | 0.1° |
| C21 | C22 | C23 | C16 | 179.1° | 179.8° |
| C21 | C22 | C16 | C15 | 139.7° | 130.9° |
| C21 | C22 | C16 | C17 | 38.8° | 47.5° |
| C21 | C22 | C23 | H17 | 179.4° | 179.8° |
| C22 | C21 | C32 | H27 | 179.4° | 179.9° |
| C24 | C23 | C22 | H17 | 180.0° | 180.0° |
| C24 | C23 | C22 | C16 | 179.7° | 179.7° |
| C23 | C22 | C16 | C15 | 41.3° | 49.3° |
| C23 | C22 | C16 | C17 | 140.2° | 132.3° |
| C22 | C23 | C24 | H18 | 179.6° | 180.0° |
| C22 | C16 | C15 | C17 | 178.7° | 178.4° |
| C22 | C16 | C15 | N14 | 179.3° | 177.9° |
| C22 | C16 | C17 | C18 | 2.2° | 3.1° |
| C22 | C16 | C17 | C12 | 179.9° | 177.3° |
| C22 | C16 | C15 | H12 | 0.7° | 2.4° |
| C16 | C22 | C23 | H17 | 0.3° | 0.4° |
| C16 | C15 | N14 | H12 | 180.0° | 179.7° |
| C16 | C15 | N14 | C13 | 0.2° | 0.3° |
| C15 | C16 | C17 | C18 | 179.4° | 178.5° |
| C15 | C16 | C17 | C12 | 1.5° | 1.1° |
| N14 | C15 | C16 | C17 | 0.6° | 0.5° |
| C15 | N14 | C13 | C12 | 0.2° | 0.4° |
| C15 | N14 | C13 | H11 | 179.7° | 179.5° |
| C16 | C17 | C18 | C19 | 46.4° | 72.7° |
| C16 | C17 | C18 | C12 | 178.0° | 179.6° |
| C16 | C17 | C12 | C13 | 1.4° | 1.0° |
| C16 | C17 | C12 | C11 | 179.9° | 179.3° |
| C17 | C16 | C15 | H12 | 179.3° | 179.2° |
| C16 | C17 | C18 | H13 | 75.1° | 47.5° |
| C16 | C17 | C18 | H14 | 167.9° | 167.2° |
| C19 | C18 | C17 | H13 | 121.5° | 120.2° |
| C19 | C18 | C17 | H14 | 121.5° | 120.1° |
| C19 | C18 | C17 | C12 | 135.6° | 107.7° |
| C19 | C18 | H13 | H14 | 115.2° | 119.5° |
| C18 | C19 | H15 | H16 | 114.9° | 118.9° |
| N14 | C13 | C12 | C17 | 0.5° | 0.3° |
| N14 | C13 | C12 | H11 | 180.0° | 180.0° |
| N14 | C13 | C12 | C11 | 179.3° | 179.9° |
| C13 | N14 | C15 | H12 | 179.8° | 180.0° |
| C18 | C17 | C12 | C13 | 179.3° | 178.6° |
| C18 | C17 | C12 | C11 | 2.0° | 1.1° |
| C17 | C18 | H13 | H14 | 115.1° | 119.7° |
| C17 | C18 | C19 | H15 | 139.7° | 165.4° |
| C17 | C18 | C19 | H16 | 103.5° | 75.7° |
| C17 | C12 | C13 | C11 | 178.8° | 179.7° |
| C17 | C12 | C11 | C10 | 60.2° | 129.7° |
| C17 | C12 | C11 | C33 | 118.7° | 50.3° |
| C17 | C12 | C13 | H11 | 179.5° | 179.8° |
| C12 | C17 | C18 | H13 | 102.9° | 132.1° |
| C12 | C17 | C18 | H14 | 14.1° | 12.4° |
| C13 | C12 | C11 | C10 | 118.5° | 50.0° |
| C13 | C12 | C11 | C33 | 62.7° | 130.1° |
| C09 | O08 | C07 | C10 | 36.7° | 0.1° |
| C09 | O08 | C07 | C04 | 143.7° | 180.0° |
| O08 | C09 | H5 | H6 | 120.0° | 120.0° |
| O08 | C09 | H5 | H7 | 120.0° | 120.0° |
| O08 | C09 | H6 | H7 | 120.0° | 120.0° |
| C12 | C11 | C10 | C33 | 178.9° | 180.0° |
| C12 | C11 | C10 | C07 | 179.1° | 180.0° |
| C12 | C11 | C33 | C03 | 179.4° | 180.0° |
| C12 | C11 | C10 | H1 | 0.9° | 0.2° |
| C11 | C12 | C13 | H11 | 0.7° | 0.1° |
| C12 | C11 | C33 | H28 | 0.7° | 0.1° |
| C11 | C10 | C07 | H1 | 180.0° | 179.8° |
| C11 | C10 | C07 | O08 | 179.8° | 180.0° |
| C11 | C10 | C07 | C04 | 0.1° | 0.0° |
| C10 | C11 | C33 | C03 | 0.4° | 0.0° |
| C10 | C11 | C33 | H28 | 179.6° | 179.9° |
| C10 | C07 | O08 | C04 | 179.6° | 180.0° |
| C07 | C10 | C11 | C33 | 0.2° | 0.0° |
| C10 | C07 | C04 | C03 | 0.2° | 0.0° |
| C10 | C07 | C04 | O05 | 179.8° | 180.0° |
| O08 | C07 | C04 | C03 | 179.8° | 180.0° |
| O08 | C07 | C04 | O05 | 0.2° | 0.0° |
| O08 | C07 | C10 | H1 | 0.2° | 0.2° |
| C07 | O08 | C09 | H5 | 180.0° | 60.0° |
| C07 | O08 | C09 | H6 | 60.0° | 60.0° |
| C07 | O08 | C09 | H7 | 60.0° | 180.0° |
| C11 | C33 | C03 | H28 | 180.0° | 179.9° |
| C11 | C33 | C03 | C04 | 0.4° | 0.1° |
| C11 | C33 | C03 | O02 | 179.8° | 179.9° |
| C33 | C11 | C10 | H1 | 179.8° | 179.8° |
| C07 | C04 | C03 | C33 | 0.0° | 0.0° |
| C07 | C04 | C03 | O05 | 180.0° | 180.0° |
| C07 | C04 | O05 | C06 | 74.5° | 90.0° |
| C07 | C04 | C03 | O02 | 179.9° | 180.0° |
| C04 | C07 | C10 | H1 | 179.9° | 179.8° |
| C33 | C03 | C04 | O02 | 179.9° | 180.0° |
| C33 | C03 | C04 | O05 | 180.0° | 180.0° |
| C33 | C03 | O02 | C01 | 11.4° | 0.0° |
| C03 | C04 | O05 | C06 | 105.5° | 90.0° |
| C04 | C03 | O02 | C01 | 168.8° | 180.0° |
| C04 | C03 | C33 | H28 | 179.7° | 179.9° |
| O05 | C04 | C03 | O02 | 0.1° | 0.0° |
| C04 | O05 | C06 | H2 | 180.0° | 60.0° |
| C04 | O05 | C06 | H3 | 60.0° | 60.0° |
| C04 | O05 | C06 | H4 | 60.0° | 180.0° |
| O05 | C06 | H2 | H3 | 120.0° | 120.0° |
| O05 | C06 | H2 | H4 | 120.0° | 120.0° |
| O05 | C06 | H3 | H4 | 120.0° | 120.0° |
| C03 | O02 | C01 | H8 | 180.0° | 60.0° |
| C03 | O02 | C01 | H9 | 60.0° | 60.0° |
| C03 | O02 | C01 | H10 | 60.0° | 180.0° |
| O02 | C03 | C33 | H28 | 0.2° | 0.1° |
| O02 | C01 | H8 | H9 | 120.0° | 120.0° |
| O02 | C01 | H8 | H10 | 120.0° | 120.0° |
| O02 | C01 | H9 | H10 | 120.0° | 120.0° |
| H2 | C06 | H3 | H4 | 120.0° | 120.0° |
| H5 | C09 | H6 | H7 | 120.0° | 120.0° |
| H8 | C01 | H9 | H10 | 120.0° | 120.0° |
| H13 | C18 | C19 | H15 | 18.2° | 45.1° |
| H13 | C18 | C19 | H16 | 135.1° | 164.1° |
| H14 | C18 | C19 | H15 | 98.8° | 74.4° |
| H14 | C18 | C19 | H16 | 18.0° | 44.5° |
| H17 | C23 | C24 | H18 | 0.3° | 0.0° |
| H19 | C27 | C28 | H21 | 76.8° | 178.4° |
| H19 | C27 | C28 | H22 | 41.7° | 58.3° |
| H20 | C27 | C28 | H21 | 41.3° | 58.5° |
| H20 | C27 | C28 | H22 | 159.7° | 61.7° |
| H21 | C28 | N29 | H29 | 14.1° | 63.2° |
| H22 | C28 | N29 | H29 | 104.3° | 56.8° |
| H23 | C30 | C31 | H25 | 168.9° | 61.7° |
| H23 | C30 | C31 | H26 | 50.9° | 58.3° |
| H23 | C30 | N29 | H29 | 58.7° | 56.9° |
| H24 | C30 | C31 | H25 | 49.7° | 58.3° |
| H24 | C30 | C31 | H26 | 68.3° | 178.4° |
| H24 | C30 | N29 | H29 | 60.4° | 63.2° |
