GKZ
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| CL | C29 | sing | 1.74Å | 1.77Å | |
| C28 | C29 | doub | 1.39Å | 1.39Å | Aromatic |
| C28 | C27 | sing | 1.38Å | 1.40Å | Aromatic |
| C29 | C30 | sing | 1.38Å | 1.40Å | Aromatic |
| C22 | C21 | sing | 1.53Å | 1.54Å | |
| C22 | N17 | sing | 1.47Å | 1.43Å | |
| C16 | N17 | sing | 1.47Å | 1.24Å | |
| C16 | C15 | sing | 1.53Å | 1.58Å | |
| C27 | C26 | doub | 1.39Å | 1.40Å | Aromatic |
| C21 | C20 | sing | 1.53Å | 1.46Å | |
| N17 | C18 | sing | 1.47Å | 1.43Å | |
| C15 | O14 | sing | 1.43Å | 1.43Å | |
| O14 | C10 | sing | 1.36Å | 1.41Å | |
| C30 | C31 | doub | 1.38Å | 1.40Å | Aromatic |
| C18 | C19 | sing | 1.53Å | 1.55Å | |
| C10 | C09 | doub | 1.39Å | 1.40Å | Aromatic |
| C10 | C11 | sing | 1.39Å | 1.40Å | Aromatic |
| C09 | C08 | sing | 1.38Å | 1.40Å | Aromatic |
| C26 | C31 | sing | 1.39Å | 1.40Å | Aromatic |
| C26 | C03 | sing | 1.48Å | 1.44Å | |
| C11 | C12 | doub | 1.38Å | 1.40Å | Aromatic |
| C20 | C19 | sing | 1.53Å | 1.43Å | |
| C20 | C23 | sing | 1.51Å | 1.58Å | |
| C08 | C07 | doub | 1.40Å | 1.40Å | Aromatic |
| O24 | C23 | doub | 1.21Å | 1.19Å | |
| C12 | C07 | sing | 1.40Å | 1.41Å | Aromatic |
| C12 | O13 | sing | 1.36Å | 1.43Å | |
| C07 | C04 | sing | 1.48Å | 1.39Å | |
| C23 | N25 | sing | 1.35Å | 1.49Å | |
| C03 | C04 | doub | 1.39Å | 1.42Å | Aromatic |
| C03 | C02 | sing | 1.41Å | 1.42Å | Aromatic |
| C04 | N05 | sing | 1.36Å | 1.36Å | Aromatic |
| C02 | C01 | sing | 1.51Å | 1.56Å | |
| C02 | N06 | doub | 1.31Å | 1.35Å | Aromatic |
| N05 | N06 | sing | 1.40Å | 1.38Å | Aromatic |
| C15 | H1 | sing | 1.09Å | 1.10Å | |
| C15 | H2 | sing | 1.09Å | 1.10Å | |
| C20 | H3 | sing | 1.09Å | 1.10Å | |
| C21 | H4 | sing | 1.09Å | 1.10Å | |
| C21 | H5 | sing | 1.09Å | 1.10Å | |
| C22 | H6 | sing | 1.09Å | 1.10Å | |
| C22 | H7 | sing | 1.09Å | 1.10Å | |
| C28 | H8 | sing | 1.08Å | 1.08Å | |
| C01 | H9 | sing | 1.09Å | 1.10Å | |
| C01 | H10 | sing | 1.09Å | 1.10Å | |
| C01 | H11 | sing | 1.09Å | 1.10Å | |
| C08 | H12 | sing | 1.08Å | 1.08Å | |
| C09 | H13 | sing | 1.08Å | 1.08Å | |
| C11 | H14 | sing | 1.08Å | 1.08Å | |
| C16 | H15 | sing | 1.09Å | 1.10Å | |
| C16 | H16 | sing | 1.09Å | 1.10Å | |
| C18 | H17 | sing | 1.09Å | 1.10Å | |
| C18 | H18 | sing | 1.09Å | 1.10Å | |
| C19 | H19 | sing | 1.09Å | 1.10Å | |
| C19 | H20 | sing | 1.09Å | 1.10Å | |
| C27 | H21 | sing | 1.08Å | 1.08Å | |
| C30 | H22 | sing | 1.08Å | 1.08Å | |
| C31 | H23 | sing | 1.08Å | 1.08Å | |
| N05 | H24 | sing | 0.97Å | 1.00Å | |
| N17 | H25 | sing | 1.01Å | 1.00Å | |
| N25 | H26 | sing | 0.97Å | 1.00Å | |
| N25 | H27 | sing | 0.97Å | 1.00Å | |
| O13 | H28 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| CL | C29 | C28 | 120.3° | 119.9° |
| CL | C29 | C30 | 120.0° | 119.9° |
| C29 | C28 | C27 | 120.2° | 120.2° |
| C28 | C29 | C30 | 119.7° | 120.2° |
| C29 | C28 | H8 | 119.9° | 119.9° |
| C28 | C27 | C26 | 120.2° | 119.8° |
| C27 | C28 | H8 | 119.9° | 120.0° |
| C28 | C27 | H21 | 119.9° | 120.1° |
| C29 | C30 | C31 | 120.1° | 120.1° |
| C29 | C30 | H22 | 119.9° | 119.9° |
| C21 | C22 | N17 | 112.9° | 109.6° |
| C22 | C21 | C20 | 114.9° | 109.3° |
| C22 | C21 | H4 | 108.1° | 109.5° |
| C22 | C21 | H5 | 108.1° | 109.6° |
| C21 | C22 | H6 | 108.6° | 109.5° |
| C21 | C22 | H7 | 108.6° | 109.5° |
| C22 | N17 | C16 | 109.5° | 109.4° |
| C22 | N17 | C18 | 109.0° | 109.9° |
| N17 | C22 | H6 | 108.6° | 109.4° |
| N17 | C22 | H7 | 108.6° | 109.4° |
| C22 | N17 | H25 | 108.1° | 109.4° |
| N17 | C16 | C15 | 111.7° | 109.5° |
| C16 | N17 | C18 | 110.9° | 109.4° |
| N17 | C16 | H15 | 108.9° | 109.5° |
| N17 | C16 | H16 | 108.9° | 109.5° |
| C16 | N17 | H25 | 111.0° | 109.4° |
| C16 | C15 | O14 | 107.4° | 109.5° |
| C16 | C15 | H1 | 110.0° | 109.5° |
| C16 | C15 | H2 | 110.0° | 109.5° |
| C15 | C16 | H15 | 108.9° | 109.5° |
| C15 | C16 | H16 | 108.9° | 109.5° |
| C27 | C26 | C31 | 119.4° | 119.8° |
| C27 | C26 | C03 | 118.8° | 120.0° |
| C26 | C27 | H21 | 119.9° | 120.1° |
| C21 | C20 | C19 | 115.5° | 109.1° |
| C21 | C20 | C23 | 109.0° | 109.5° |
| C21 | C20 | H3 | 108.1° | 109.6° |
| C20 | C21 | H4 | 108.1° | 109.5° |
| C20 | C21 | H5 | 108.1° | 109.5° |
| N17 | C18 | C19 | 111.2° | 109.6° |
| N17 | C18 | H17 | 109.1° | 109.4° |
| N17 | C18 | H18 | 109.0° | 109.4° |
| C18 | N17 | H25 | 108.2° | 109.3° |
| C15 | O14 | C10 | 116.5° | 117.0° |
| O14 | C15 | H1 | 110.0° | 109.5° |
| O14 | C15 | H2 | 110.0° | 109.4° |
| O14 | C10 | C09 | 119.3° | 119.9° |
| O14 | C10 | C11 | 121.0° | 119.9° |
| C30 | C31 | C26 | 120.3° | 119.9° |
| C31 | C30 | H22 | 120.0° | 120.0° |
| C30 | C31 | H23 | 119.8° | 120.0° |
| C18 | C19 | C20 | 114.2° | 109.3° |
| C19 | C18 | H17 | 109.0° | 109.5° |
| C19 | C18 | H18 | 109.1° | 109.5° |
| C18 | C19 | H19 | 108.3° | 109.6° |
| C18 | C19 | H20 | 108.3° | 109.5° |
| C09 | C10 | C11 | 119.7° | 120.2° |
| C10 | C09 | C08 | 120.3° | 120.2° |
| C10 | C09 | H13 | 119.8° | 119.9° |
| C10 | C11 | C12 | 120.1° | 120.0° |
| C10 | C11 | H14 | 120.0° | 119.9° |
| C09 | C08 | C07 | 120.1° | 119.9° |
| C09 | C08 | H12 | 120.0° | 120.0° |
| C08 | C09 | H13 | 119.9° | 119.9° |
| C31 | C26 | C03 | 121.7° | 120.1° |
| C26 | C31 | H23 | 119.8° | 120.1° |
| C26 | C03 | C04 | 130.0° | 126.4° |
| C26 | C03 | C02 | 123.4° | 126.4° |
| C11 | C12 | C07 | 120.4° | 119.8° |
| C11 | C12 | O13 | 118.9° | 120.1° |
| C12 | C11 | H14 | 120.0° | 120.0° |
| C19 | C20 | C23 | 108.8° | 109.5° |
| C19 | C20 | H3 | 108.4° | 109.6° |
| C20 | C19 | H19 | 108.3° | 109.5° |
| C20 | C19 | H20 | 108.3° | 109.5° |
| C20 | C23 | O24 | 120.1° | 120.0° |
| C20 | C23 | N25 | 120.0° | 120.0° |
| C23 | C20 | H3 | 106.7° | 109.5° |
| C08 | C07 | C12 | 119.3° | 119.8° |
| C08 | C07 | C04 | 121.3° | 120.1° |
| C07 | C08 | H12 | 119.9° | 120.1° |
| O24 | C23 | N25 | 119.9° | 120.0° |
| C07 | C12 | O13 | 120.6° | 120.1° |
| C12 | C07 | C04 | 119.4° | 120.2° |
| C12 | O13 | H28 | 109.5° | 113.9° |
| C07 | C04 | C03 | 129.8° | 126.4° |
| C07 | C04 | N05 | 123.4° | 126.5° |
| C23 | N25 | H26 | 120.0° | 120.0° |
| C23 | N25 | H27 | 120.0° | 120.0° |
| C04 | C03 | C02 | 106.6° | 107.2° |
| C03 | C04 | N05 | 106.9° | 107.0° |
| C03 | C02 | C01 | 125.9° | 125.7° |
| C03 | C02 | N06 | 108.0° | 108.6° |
| C04 | N05 | N06 | 109.8° | 108.0° |
| C04 | N05 | H24 | 125.1° | 125.9° |
| C01 | C02 | N06 | 126.1° | 125.7° |
| C02 | C01 | H9 | 109.5° | 109.5° |
| C02 | C01 | H10 | 109.4° | 109.5° |
| C02 | C01 | H11 | 109.5° | 109.5° |
| C02 | N06 | N05 | 108.8° | 109.1° |
| N06 | N05 | H24 | 125.1° | 126.0° |
| H1 | C15 | H2 | 109.5° | 109.4° |
| H4 | C21 | H5 | 109.5° | 109.4° |
| H6 | C22 | H7 | 109.5° | 109.5° |
| H9 | C01 | H10 | 109.4° | 109.5° |
| H9 | C01 | H11 | 109.4° | 109.4° |
| H10 | C01 | H11 | 109.5° | 109.4° |
| H15 | C16 | H16 | 109.5° | 109.4° |
| H17 | C18 | H18 | 109.5° | 109.4° |
| H19 | C19 | H20 | 109.5° | 109.5° |
| H26 | N25 | H27 | 120.0° | 120.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| CL | C29 | C28 | C30 | 180.0° | 179.8° |
| CL | C29 | C28 | C27 | 179.8° | 180.0° |
| CL | C29 | C30 | C31 | 180.0° | 179.7° |
| CL | C29 | C28 | H8 | 0.2° | 0.2° |
| CL | C29 | C30 | H22 | 0.0° | 0.2° |
| C29 | C28 | C27 | H8 | 180.0° | 179.8° |
| C29 | C28 | C27 | C26 | 0.7° | 0.0° |
| C28 | C29 | C30 | C31 | 0.0° | 0.5° |
| C29 | C28 | C27 | H21 | 179.3° | 180.0° |
| C28 | C29 | C30 | H22 | 180.0° | 180.0° |
| C27 | C28 | C29 | C30 | 0.2° | 0.2° |
| C28 | C27 | C26 | H21 | 180.0° | 180.0° |
| C28 | C27 | C26 | C31 | 1.0° | 0.0° |
| C28 | C27 | C26 | C03 | 179.1° | 179.7° |
| C29 | C30 | C31 | H22 | 180.0° | 179.5° |
| C29 | C30 | C31 | C26 | 0.3° | 0.5° |
| C30 | C29 | C28 | H8 | 179.8° | 180.0° |
| C29 | C30 | C31 | H23 | 179.7° | 179.5° |
| C21 | C22 | N17 | H6 | 120.5° | 120.0° |
| C21 | C22 | N17 | H7 | 120.5° | 120.0° |
| C21 | C22 | N17 | C16 | 173.6° | 176.7° |
| C22 | C21 | C20 | H4 | 120.8° | 120.0° |
| C22 | C21 | C20 | H5 | 120.8° | 120.0° |
| C21 | C22 | N17 | C18 | 52.0° | 63.1° |
| C22 | C21 | C20 | C19 | 41.8° | 56.9° |
| C22 | C21 | C20 | C23 | 164.7° | 62.9° |
| C22 | C21 | C20 | H3 | 79.8° | 176.9° |
| C22 | C21 | H4 | H5 | 117.6° | 120.1° |
| C21 | C22 | H6 | H7 | 118.4° | 120.0° |
| C21 | C22 | N17 | H25 | 65.3° | 56.9° |
| C22 | N17 | C16 | C18 | 120.4° | 120.4° |
| C22 | N17 | C16 | H25 | 119.3° | 119.9° |
| C22 | N17 | C16 | C15 | 167.4° | 66.0° |
| N17 | C22 | C21 | C20 | 1.0° | 60.0° |
| C22 | N17 | C18 | H25 | 117.3° | 120.1° |
| C22 | N17 | C18 | C19 | 65.7° | 63.2° |
| N17 | C22 | C21 | H4 | 121.8° | 179.9° |
| N17 | C22 | C21 | H5 | 119.8° | 60.0° |
| N17 | C22 | H6 | H7 | 118.4° | 119.9° |
| C22 | N17 | C16 | H15 | 72.3° | 54.1° |
| C22 | N17 | C16 | H16 | 47.1° | 174.0° |
| C22 | N17 | C18 | H17 | 54.6° | 176.8° |
| C22 | N17 | C18 | H18 | 174.0° | 56.9° |
| N17 | C16 | C15 | H15 | 120.3° | 120.0° |
| N17 | C16 | C15 | H16 | 120.4° | 120.0° |
| C16 | N17 | C18 | H25 | 122.0° | 119.8° |
| N17 | C16 | C15 | O14 | 103.1° | 63.8° |
| C16 | N17 | C18 | C19 | 173.6° | 176.7° |
| N17 | C16 | C15 | H1 | 137.2° | 176.1° |
| N17 | C16 | C15 | H2 | 16.6° | 56.1° |
| C16 | N17 | C22 | H6 | 53.1° | 63.2° |
| C16 | N17 | C22 | H7 | 65.9° | 56.7° |
| N17 | C16 | H15 | H16 | 119.0° | 120.0° |
| C16 | N17 | C18 | H17 | 66.2° | 56.7° |
| C16 | N17 | C18 | H18 | 53.3° | 63.2° |
| C15 | C16 | N17 | C18 | 72.2° | 173.6° |
| C16 | C15 | O14 | H1 | 119.7° | 120.1° |
| C16 | C15 | O14 | H2 | 119.7° | 120.0° |
| C16 | C15 | O14 | C10 | 168.9° | 179.9° |
| C16 | C15 | H1 | H2 | 120.9° | 120.0° |
| C15 | C16 | H15 | H16 | 119.0° | 120.0° |
| C15 | C16 | N17 | H25 | 48.1° | 53.9° |
| C27 | C26 | C31 | C30 | 0.8° | 0.2° |
| C27 | C26 | C31 | C03 | 178.1° | 179.7° |
| C27 | C26 | C03 | C04 | 64.6° | 65.9° |
| C27 | C26 | C03 | C02 | 113.1° | 114.3° |
| C26 | C27 | C28 | H8 | 179.3° | 179.8° |
| C27 | C26 | C31 | H23 | 179.2° | 179.7° |
| C21 | C20 | C19 | C18 | 28.5° | 56.9° |
| C21 | C20 | C19 | C23 | 123.0° | 119.9° |
| C21 | C20 | C19 | H3 | 121.4° | 120.0° |
| C21 | C20 | C23 | H3 | 116.4° | 120.2° |
| C21 | C20 | C23 | O24 | 47.3° | 119.6° |
| C21 | C20 | C23 | N25 | 132.9° | 60.4° |
| C20 | C21 | H4 | H5 | 117.5° | 120.0° |
| C20 | C21 | C22 | H6 | 121.5° | 60.0° |
| C20 | C21 | C22 | H7 | 119.5° | 180.0° |
| C21 | C20 | C19 | H19 | 92.2° | 63.0° |
| C21 | C20 | C19 | H20 | 149.2° | 176.9° |
| N17 | C18 | C19 | H17 | 120.3° | 120.0° |
| N17 | C18 | C19 | H18 | 120.2° | 120.0° |
| N17 | C18 | C19 | C20 | 24.7° | 60.0° |
| C18 | N17 | C22 | H6 | 68.5° | 56.9° |
| C18 | N17 | C22 | H7 | 172.5° | 176.8° |
| C18 | N17 | C16 | H15 | 48.1° | 66.3° |
| C18 | N17 | C16 | H16 | 167.5° | 53.6° |
| N17 | C18 | H17 | H18 | 119.2° | 119.8° |
| N17 | C18 | C19 | H19 | 145.4° | 59.9° |
| N17 | C18 | C19 | H20 | 96.0° | 179.9° |
| C15 | O14 | C10 | C09 | 175.5° | 0.1° |
| C15 | O14 | C10 | C11 | 4.4° | 179.8° |
| O14 | C15 | H1 | H2 | 120.9° | 120.0° |
| O14 | C15 | C16 | H15 | 17.2° | 176.2° |
| O14 | C15 | C16 | H16 | 136.6° | 56.2° |
| O14 | C10 | C09 | C11 | 179.9° | 179.8° |
| O14 | C10 | C09 | C08 | 180.0° | 179.8° |
| O14 | C10 | C11 | C12 | 180.0° | 179.8° |
| C10 | O14 | C15 | H1 | 49.2° | 60.0° |
| C10 | O14 | C15 | H2 | 71.5° | 60.0° |
| O14 | C10 | C09 | H13 | 0.0° | 0.1° |
| O14 | C10 | C11 | H14 | 0.0° | 0.2° |
| C30 | C31 | C26 | H23 | 180.0° | 180.0° |
| C30 | C31 | C26 | C03 | 178.9° | 180.0° |
| C18 | C19 | C20 | H19 | 120.7° | 120.0° |
| C18 | C19 | C20 | H20 | 120.7° | 119.9° |
| C18 | C19 | C20 | C23 | 151.5° | 62.9° |
| C18 | C19 | C20 | H3 | 92.9° | 176.9° |
| C19 | C18 | H17 | H18 | 119.2° | 120.0° |
| C18 | C19 | H19 | H20 | 117.9° | 120.2° |
| C19 | C18 | N17 | H25 | 51.6° | 56.9° |
| C10 | C09 | C08 | H13 | 180.0° | 179.9° |
| C09 | C10 | C11 | C12 | 0.1° | 0.1° |
| C10 | C09 | C08 | C07 | 0.4° | 0.0° |
| C10 | C09 | C08 | H12 | 179.6° | 180.0° |
| C09 | C10 | C11 | H14 | 179.9° | 179.9° |
| C11 | C10 | C09 | C08 | 0.1° | 0.1° |
| C10 | C11 | C12 | H14 | 180.0° | 180.0° |
| C10 | C11 | C12 | C07 | 0.4° | 0.0° |
| C10 | C11 | C12 | O13 | 179.9° | 180.0° |
| C11 | C10 | C09 | H13 | 179.9° | 180.0° |
| C09 | C08 | C07 | H12 | 180.0° | 180.0° |
| C09 | C08 | C07 | C12 | 0.9° | 0.1° |
| C09 | C08 | C07 | C04 | 179.4° | 179.9° |
| C31 | C26 | C03 | C04 | 117.3° | 113.9° |
| C31 | C26 | C03 | C02 | 65.0° | 66.0° |
| C31 | C26 | C27 | H21 | 179.0° | 180.0° |
| C26 | C31 | C30 | H22 | 179.7° | 180.0° |
| C26 | C03 | C04 | C07 | 2.0° | 0.1° |
| C26 | C03 | C04 | C02 | 178.0° | 179.9° |
| C26 | C03 | C04 | N05 | 179.0° | 179.9° |
| C26 | C03 | C02 | C01 | 1.2° | 0.1° |
| C26 | C03 | C02 | N06 | 179.2° | 179.9° |
| C03 | C26 | C27 | H21 | 0.9° | 0.3° |
| C03 | C26 | C31 | H23 | 1.1° | 0.0° |
| C11 | C12 | C07 | C08 | 0.9° | 0.0° |
| C11 | C12 | C07 | O13 | 179.5° | 180.0° |
| C11 | C12 | C07 | C04 | 179.5° | 179.9° |
| C11 | C12 | O13 | H28 | 180.0° | 85.0° |
| C19 | C20 | C23 | H3 | 116.7° | 120.2° |
| C19 | C20 | C23 | O24 | 174.1° | 0.0° |
| C19 | C20 | C23 | N25 | 6.1° | 180.0° |
| C19 | C20 | C21 | H4 | 162.6° | 176.9° |
| C19 | C20 | C21 | H5 | 79.0° | 63.1° |
| C20 | C19 | C18 | H17 | 95.6° | 180.0° |
| C20 | C19 | C18 | H18 | 144.9° | 60.0° |
| C20 | C19 | H19 | H20 | 117.9° | 120.0° |
| C20 | C23 | O24 | N25 | 179.8° | 180.0° |
| C23 | C20 | C21 | H4 | 74.5° | 57.0° |
| C23 | C20 | C21 | H5 | 43.9° | 177.0° |
| C23 | C20 | C19 | H19 | 30.8° | 177.1° |
| C23 | C20 | C19 | H20 | 87.8° | 57.0° |
| C20 | C23 | N25 | H26 | 179.8° | 0.0° |
| C20 | C23 | N25 | H27 | 0.2° | 180.0° |
| C08 | C07 | C12 | C04 | 178.6° | 179.9° |
| C08 | C07 | C12 | O13 | 179.6° | 180.0° |
| C08 | C07 | C04 | C03 | 40.9° | 113.9° |
| C08 | C07 | C04 | N05 | 137.8° | 66.1° |
| C07 | C08 | C09 | H13 | 179.6° | 179.9° |
| O24 | C23 | C20 | H3 | 69.2° | 120.2° |
| O24 | C23 | N25 | H26 | 0.0° | 180.0° |
| O24 | C23 | N25 | H27 | 180.0° | 0.0° |
| C12 | C07 | C04 | C03 | 140.5° | 66.2° |
| C12 | C07 | C04 | N05 | 40.8° | 113.8° |
| C12 | C07 | C08 | H12 | 179.1° | 179.9° |
| C07 | C12 | C11 | H14 | 179.6° | 180.0° |
| C07 | C12 | O13 | H28 | 0.5° | 95.0° |
| O13 | C12 | C07 | C04 | 1.0° | 0.1° |
| O13 | C12 | C11 | H14 | 0.1° | 0.0° |
| C07 | C04 | C03 | N05 | 178.9° | 180.0° |
| C07 | C04 | C03 | C02 | 179.9° | 180.0° |
| C07 | C04 | N05 | N06 | 179.7° | 179.8° |
| C04 | C07 | C08 | H12 | 0.6° | 0.0° |
| C07 | C04 | N05 | H24 | 0.3° | 0.1° |
| N25 | C23 | C20 | H3 | 110.6° | 59.8° |
| C23 | N25 | H26 | H27 | 180.0° | 179.9° |
| C04 | C03 | C02 | C01 | 179.4° | 180.0° |
| C04 | C03 | C02 | N06 | 1.0° | 0.2° |
| C03 | C04 | N05 | N06 | 0.7° | 0.2° |
| C03 | C04 | N05 | H24 | 179.4° | 179.9° |
| C02 | C03 | C04 | N05 | 1.0° | 0.0° |
| C03 | C02 | C01 | N06 | 179.5° | 179.7° |
| C03 | C02 | N06 | N05 | 0.6° | 0.3° |
| C03 | C02 | C01 | H9 | 179.5° | 89.7° |
| C03 | C02 | C01 | H10 | 59.5° | 30.4° |
| C03 | C02 | C01 | H11 | 60.5° | 150.3° |
| C04 | N05 | N06 | C02 | 0.1° | 0.3° |
| C04 | N05 | N06 | H24 | 180.0° | 179.9° |
| C01 | C02 | N06 | N05 | 179.8° | 179.9° |
| C02 | C01 | H9 | H10 | 120.0° | 120.0° |
| C02 | C01 | H9 | H11 | 120.0° | 120.0° |
| C02 | C01 | H10 | H11 | 120.0° | 120.0° |
| N06 | C02 | C01 | H9 | 0.0° | 90.0° |
| N06 | C02 | C01 | H10 | 120.0° | 150.0° |
| N06 | C02 | C01 | H11 | 120.0° | 30.0° |
| C02 | N06 | N05 | H24 | 179.9° | 179.8° |
| H1 | C15 | C16 | H15 | 102.5° | 56.1° |
| H1 | C15 | C16 | H16 | 16.9° | 63.8° |
| H2 | C15 | C16 | H15 | 136.9° | 63.9° |
| H2 | C15 | C16 | H16 | 103.8° | 176.1° |
| H3 | C20 | C21 | H4 | 41.0° | 63.2° |
| H3 | C20 | C21 | H5 | 159.4° | 56.9° |
| H3 | C20 | C19 | H19 | 146.4° | 56.9° |
| H3 | C20 | C19 | H20 | 27.8° | 63.2° |
| H4 | C21 | C22 | H6 | 117.7° | 59.9° |
| H4 | C21 | C22 | H7 | 1.3° | 60.1° |
| H5 | C21 | C22 | H6 | 0.7° | 180.0° |
| H5 | C21 | C22 | H7 | 119.7° | 60.0° |
| H6 | C22 | N17 | H25 | 174.1° | 176.9° |
| H7 | C22 | N17 | H25 | 55.1° | 63.1° |
| H8 | C28 | C27 | H21 | 0.7° | 0.2° |
| H9 | C01 | H10 | H11 | 120.0° | 120.0° |
| H12 | C08 | C09 | H13 | 0.4° | 0.1° |
| H15 | C16 | N17 | H25 | 168.5° | 173.9° |
| H16 | C16 | N17 | H25 | 72.2° | 66.1° |
| H17 | C18 | C19 | H19 | 25.1° | 60.1° |
| H17 | C18 | C19 | H20 | 143.7° | 60.1° |
| H17 | C18 | N17 | H25 | 171.9° | 63.1° |
| H18 | C18 | C19 | H19 | 94.4° | 179.9° |
| H18 | C18 | C19 | H20 | 24.2° | 59.9° |
| H18 | C18 | N17 | H25 | 68.7° | 177.0° |
| H22 | C30 | C31 | H23 | 0.3° | 0.0° |
