FEW
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C16 | C17 | sing | 1.53Å | 1.57Å | |
| C16 | N15 | sing | 1.47Å | 1.37Å | |
| C14 | N15 | sing | 1.47Å | 1.30Å | |
| C14 | C13 | sing | 1.51Å | 1.56Å | |
| C17 | N18 | sing | 1.47Å | 1.36Å | |
| N15 | C21 | sing | 1.47Å | 1.35Å | |
| C13 | C22 | doub | 1.38Å | 1.40Å | Aromatic |
| C13 | C12 | sing | 1.38Å | 1.39Å | Aromatic |
| N18 | C19 | sing | 1.47Å | 1.28Å | |
| N18 | C20 | sing | 1.47Å | 1.38Å | |
| C22 | C23 | sing | 1.38Å | 1.42Å | Aromatic |
| C12 | C11 | doub | 1.39Å | 1.38Å | Aromatic |
| C21 | C20 | sing | 1.53Å | 1.58Å | |
| F27 | C24 | sing | 1.40Å | 1.41Å | |
| C23 | C24 | sing | 1.51Å | 1.50Å | |
| C23 | C28 | doub | 1.38Å | 1.35Å | Aromatic |
| C11 | C28 | sing | 1.39Å | 1.42Å | Aromatic |
| C11 | N10 | sing | 1.40Å | 1.48Å | |
| C24 | F25 | sing | 1.40Å | 1.40Å | |
| C24 | F26 | sing | 1.40Å | 1.35Å | |
| N10 | C08 | sing | 1.35Å | 1.46Å | |
| C06 | C05 | doub | 1.38Å | 1.38Å | Aromatic |
| C06 | C07 | sing | 1.40Å | 1.41Å | Aromatic |
| C05 | C04 | sing | 1.38Å | 1.36Å | Aromatic |
| C08 | C07 | sing | 1.48Å | 1.55Å | |
| C08 | O09 | doub | 1.22Å | 1.17Å | |
| C03 | C02 | sing | 1.53Å | 1.55Å | |
| C07 | C29 | doub | 1.39Å | 1.33Å | Aromatic |
| C04 | C02 | sing | 1.51Å | 1.58Å | |
| C04 | C30 | doub | 1.40Å | 1.39Å | Aromatic |
| C29 | C30 | sing | 1.40Å | 1.39Å | Aromatic |
| C02 | C01 | sing | 1.53Å | 1.56Å | |
| C30 | C31 | sing | 1.43Å | 1.51Å | |
| C31 | C32 | trip | 1.17Å | 1.27Å | |
| C32 | C33 | sing | 1.43Å | 1.54Å | |
| C33 | C34 | doub | 1.39Å | 1.43Å | Aromatic |
| C33 | N41 | sing | 1.37Å | 1.36Å | Aromatic |
| C34 | N35 | sing | 1.33Å | 1.31Å | Aromatic |
| N41 | C40 | sing | 1.36Å | 1.42Å | Aromatic |
| N41 | C36 | sing | 1.37Å | 1.31Å | Aromatic |
| N35 | C36 | doub | 1.33Å | 1.39Å | Aromatic |
| C40 | C39 | doub | 1.35Å | 1.35Å | Aromatic |
| C36 | C37 | sing | 1.41Å | 1.35Å | Aromatic |
| C39 | N38 | sing | 1.33Å | 1.32Å | Aromatic |
| C37 | N38 | doub | 1.31Å | 1.41Å | Aromatic |
| C17 | H1 | sing | 1.09Å | 1.10Å | |
| C17 | H2 | sing | 1.09Å | 1.10Å | |
| C20 | H3 | sing | 1.09Å | 1.10Å | |
| C20 | H4 | sing | 1.09Å | 1.10Å | |
| C21 | H5 | sing | 1.09Å | 1.10Å | |
| C21 | H6 | sing | 1.09Å | 1.10Å | |
| C22 | H7 | sing | 1.08Å | 1.08Å | |
| 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 | |
| C02 | H12 | sing | 1.09Å | 1.10Å | |
| C03 | H13 | sing | 1.09Å | 1.10Å | |
| C03 | H14 | sing | 1.09Å | 1.10Å | |
| C03 | H15 | sing | 1.09Å | 1.10Å | |
| C05 | H16 | sing | 1.08Å | 1.08Å | |
| C06 | H17 | sing | 1.08Å | 1.08Å | |
| C12 | H18 | sing | 1.08Å | 1.08Å | |
| C14 | H19 | sing | 1.09Å | 1.10Å | |
| C14 | H20 | sing | 1.09Å | 1.10Å | |
| C16 | H21 | sing | 1.09Å | 1.10Å | |
| C16 | H22 | sing | 1.09Å | 1.10Å | |
| C19 | H23 | sing | 1.09Å | 1.10Å | |
| C19 | H24 | sing | 1.09Å | 1.10Å | |
| C19 | H25 | sing | 1.09Å | 1.10Å | |
| C29 | H26 | sing | 1.08Å | 1.08Å | |
| C34 | H27 | sing | 1.08Å | 1.08Å | |
| C37 | H28 | sing | 1.08Å | 1.08Å | |
| C39 | H29 | sing | 1.08Å | 1.08Å | |
| C40 | H30 | sing | 1.08Å | 1.08Å | |
| N10 | H31 | sing | 0.97Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C17 | C16 | N15 | 109.7° | 109.4° |
| C16 | C17 | N18 | 115.1° | 109.4° |
| C16 | C17 | H1 | 108.1° | 109.4° |
| C16 | C17 | H2 | 108.0° | 109.5° |
| C17 | C16 | H21 | 109.4° | 109.4° |
| C17 | C16 | H22 | 109.4° | 109.5° |
| C16 | N15 | C14 | 113.8° | 111.0° |
| C16 | N15 | C21 | 112.7° | 110.9° |
| N15 | C16 | H21 | 109.4° | 109.5° |
| N15 | C16 | H22 | 109.4° | 109.5° |
| N15 | C14 | C13 | 116.9° | 109.4° |
| C14 | N15 | C21 | 114.8° | 111.0° |
| N15 | C14 | H19 | 107.6° | 109.5° |
| N15 | C14 | H20 | 107.6° | 109.5° |
| C14 | C13 | C22 | 119.6° | 120.0° |
| C14 | C13 | C12 | 121.3° | 119.9° |
| C13 | C14 | H19 | 107.6° | 109.5° |
| C13 | C14 | H20 | 107.6° | 109.4° |
| C17 | N18 | C19 | 110.0° | 111.0° |
| C17 | N18 | C20 | 118.2° | 110.9° |
| N18 | C17 | H1 | 108.1° | 109.5° |
| N18 | C17 | H2 | 108.1° | 109.5° |
| N15 | C21 | C20 | 114.1° | 109.4° |
| N15 | C21 | H5 | 108.3° | 109.4° |
| N15 | C21 | H6 | 108.3° | 109.5° |
| C22 | C13 | C12 | 119.1° | 120.1° |
| C13 | C22 | C23 | 120.6° | 120.1° |
| C13 | C22 | H7 | 119.7° | 119.9° |
| C13 | C12 | C11 | 120.2° | 119.9° |
| C13 | C12 | H18 | 119.9° | 120.0° |
| C19 | N18 | C20 | 110.2° | 111.0° |
| N18 | C19 | H23 | 109.5° | 109.5° |
| N18 | C19 | H24 | 109.4° | 109.5° |
| N18 | C19 | H25 | 109.4° | 109.5° |
| N18 | C20 | C21 | 117.1° | 109.4° |
| N18 | C20 | H3 | 107.5° | 109.5° |
| N18 | C20 | H4 | 107.5° | 109.5° |
| C22 | C23 | C24 | 120.9° | 120.0° |
| C22 | C23 | C28 | 119.8° | 120.1° |
| C23 | C22 | H7 | 119.7° | 119.9° |
| C12 | C11 | C28 | 120.2° | 119.9° |
| C12 | C11 | N10 | 119.8° | 120.0° |
| C11 | C12 | H18 | 119.8° | 120.1° |
| C21 | C20 | H3 | 107.6° | 109.5° |
| C21 | C20 | H4 | 107.5° | 109.5° |
| C20 | C21 | H5 | 108.3° | 109.5° |
| C20 | C21 | H6 | 108.3° | 109.5° |
| F27 | C24 | C23 | 110.0° | 109.5° |
| F27 | C24 | F25 | 109.4° | 109.5° |
| F27 | C24 | F26 | 109.4° | 109.5° |
| C24 | C23 | C28 | 119.3° | 119.9° |
| C23 | C24 | F25 | 108.3° | 109.5° |
| C23 | C24 | F26 | 110.8° | 109.5° |
| C23 | C28 | C11 | 120.1° | 119.9° |
| C23 | C28 | H8 | 119.9° | 120.1° |
| C28 | C11 | N10 | 119.9° | 120.1° |
| C11 | C28 | H8 | 120.0° | 120.0° |
| C11 | N10 | C08 | 123.6° | 120.0° |
| C11 | N10 | H31 | 118.2° | 120.0° |
| F25 | C24 | F26 | 108.9° | 109.5° |
| N10 | C08 | C07 | 117.8° | 120.0° |
| N10 | C08 | O09 | 122.7° | 120.0° |
| C08 | N10 | H31 | 118.2° | 120.0° |
| C05 | C06 | C07 | 119.4° | 120.1° |
| C06 | C05 | C04 | 119.7° | 120.4° |
| C06 | C05 | H16 | 120.1° | 119.8° |
| C05 | C06 | H17 | 120.3° | 119.9° |
| C06 | C07 | C08 | 121.1° | 120.0° |
| C06 | C07 | C29 | 120.8° | 119.9° |
| C07 | C06 | H17 | 120.3° | 119.9° |
| C05 | C04 | C02 | 120.7° | 119.9° |
| C05 | C04 | C30 | 120.1° | 120.1° |
| C04 | C05 | H16 | 120.2° | 119.8° |
| C07 | C08 | O09 | 119.5° | 120.0° |
| C08 | C07 | C29 | 118.0° | 120.1° |
| C03 | C02 | C04 | 110.6° | 109.5° |
| C03 | C02 | C01 | 112.0° | 109.5° |
| C03 | C02 | H12 | 107.1° | 109.5° |
| C02 | C03 | H13 | 109.5° | 109.4° |
| C02 | C03 | H14 | 109.5° | 109.5° |
| C02 | C03 | H15 | 109.4° | 109.4° |
| C07 | C29 | C30 | 119.6° | 119.7° |
| C07 | C29 | H26 | 120.2° | 120.1° |
| C02 | C04 | C30 | 119.2° | 119.9° |
| C04 | C02 | C01 | 112.9° | 109.5° |
| C04 | C02 | H12 | 106.8° | 109.5° |
| C04 | C30 | C29 | 120.4° | 119.8° |
| C04 | C30 | C31 | 121.7° | 120.2° |
| C29 | C30 | C31 | 117.9° | 120.1° |
| C30 | C29 | H26 | 120.2° | 120.2° |
| C02 | C01 | H9 | 109.5° | 109.5° |
| C02 | C01 | H10 | 109.5° | 109.5° |
| C02 | C01 | H11 | 109.4° | 109.5° |
| C01 | C02 | H12 | 107.1° | 109.4° |
| C30 | C31 | C32 | 178.2° | 179.9° |
| C31 | C32 | C33 | 178.4° | 180.0° |
| C32 | C33 | C34 | 125.8° | 126.7° |
| C32 | C33 | N41 | 126.6° | 126.7° |
| C34 | C33 | N41 | 107.6° | 106.6° |
| C33 | C34 | N35 | 106.6° | 108.2° |
| C33 | C34 | H27 | 126.7° | 125.9° |
| C33 | N41 | C40 | 131.6° | 133.7° |
| C33 | N41 | C36 | 107.7° | 107.1° |
| C34 | N35 | C36 | 108.4° | 109.7° |
| N35 | C34 | H27 | 126.7° | 125.9° |
| C40 | N41 | C36 | 120.7° | 119.2° |
| N41 | C40 | C39 | 118.9° | 119.8° |
| N41 | C40 | H30 | 120.5° | 120.2° |
| N41 | C36 | N35 | 109.8° | 108.5° |
| N41 | C36 | C37 | 120.1° | 118.7° |
| N35 | C36 | C37 | 130.1° | 132.8° |
| C40 | C39 | N38 | 120.6° | 121.1° |
| C40 | C39 | H29 | 119.7° | 119.5° |
| C39 | C40 | H30 | 120.6° | 120.1° |
| C36 | C37 | N38 | 119.6° | 119.7° |
| C36 | C37 | H28 | 120.2° | 120.1° |
| C39 | N38 | C37 | 120.1° | 121.4° |
| N38 | C39 | H29 | 119.7° | 119.4° |
| N38 | C37 | H28 | 120.2° | 120.1° |
| H1 | C17 | H2 | 109.5° | 109.5° |
| H3 | C20 | H4 | 109.5° | 109.5° |
| H5 | C21 | H6 | 109.4° | 109.5° |
| H9 | C01 | H10 | 109.4° | 109.5° |
| H9 | C01 | H11 | 109.5° | 109.4° |
| H10 | C01 | H11 | 109.5° | 109.4° |
| H13 | C03 | H14 | 109.5° | 109.5° |
| H13 | C03 | H15 | 109.5° | 109.5° |
| H14 | C03 | H15 | 109.5° | 109.4° |
| H19 | C14 | H20 | 109.5° | 109.5° |
| H21 | C16 | H22 | 109.5° | 109.5° |
| H23 | C19 | H24 | 109.5° | 109.5° |
| H23 | C19 | H25 | 109.5° | 109.5° |
| H24 | C19 | H25 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C17 | C16 | N15 | H21 | 120.0° | 119.9° |
| C17 | C16 | N15 | H22 | 120.0° | 120.0° |
| C17 | C16 | N15 | C14 | 162.4° | 176.8° |
| C16 | C17 | N18 | H1 | 120.8° | 119.9° |
| C16 | C17 | N18 | H2 | 120.8° | 120.0° |
| C17 | C16 | N15 | C21 | 64.5° | 59.3° |
| C16 | C17 | N18 | C19 | 132.1° | 64.6° |
| C16 | C17 | N18 | C20 | 4.4° | 59.3° |
| C16 | C17 | H1 | H2 | 117.4° | 120.0° |
| C17 | C16 | H21 | H22 | 119.9° | 120.0° |
| C16 | N15 | C14 | C21 | 132.0° | 123.8° |
| C16 | N15 | C14 | C13 | 96.3° | 170.0° |
| N15 | C16 | C17 | N18 | 42.7° | 58.4° |
| C16 | N15 | C21 | C20 | 39.6° | 59.3° |
| N15 | C16 | C17 | H1 | 78.2° | 61.6° |
| N15 | C16 | C17 | H2 | 163.5° | 178.4° |
| C16 | N15 | C21 | H5 | 81.1° | 179.3° |
| C16 | N15 | C21 | H6 | 160.3° | 60.7° |
| C16 | N15 | C14 | H19 | 24.8° | 50.0° |
| C16 | N15 | C14 | H20 | 142.7° | 70.1° |
| N15 | C16 | H21 | H22 | 119.9° | 120.1° |
| N15 | C14 | C13 | H19 | 121.1° | 120.0° |
| N15 | C14 | C13 | H20 | 121.1° | 119.9° |
| N15 | C14 | C13 | C22 | 121.4° | 90.0° |
| N15 | C14 | C13 | C12 | 60.5° | 90.3° |
| C14 | N15 | C21 | C20 | 172.1° | 176.8° |
| C14 | N15 | C21 | H5 | 51.4° | 56.9° |
| C14 | N15 | C21 | H6 | 67.2° | 63.1° |
| N15 | C14 | H19 | H20 | 116.6° | 120.1° |
| C14 | N15 | C16 | H21 | 77.6° | 63.3° |
| C14 | N15 | C16 | H22 | 42.4° | 56.8° |
| C13 | C14 | N15 | C21 | 35.8° | 66.2° |
| C14 | C13 | C22 | C12 | 178.2° | 179.7° |
| C14 | C13 | C22 | C23 | 179.1° | 179.7° |
| C14 | C13 | C12 | C11 | 179.7° | 179.7° |
| C14 | C13 | C22 | H7 | 0.9° | 0.3° |
| C14 | C13 | C12 | H18 | 0.3° | 0.3° |
| C13 | C14 | H19 | H20 | 116.6° | 120.0° |
| C17 | N18 | C19 | C20 | 132.0° | 123.8° |
| C17 | N18 | C20 | C21 | 29.4° | 59.3° |
| N18 | C17 | H1 | H2 | 117.5° | 120.1° |
| C17 | N18 | C20 | H3 | 150.5° | 179.3° |
| C17 | N18 | C20 | H4 | 91.7° | 60.7° |
| N18 | C17 | C16 | H21 | 77.4° | 61.6° |
| N18 | C17 | C16 | H22 | 162.7° | 178.4° |
| C17 | N18 | C19 | H23 | 180.0° | 60.0° |
| C17 | N18 | C19 | H24 | 60.0° | 180.0° |
| C17 | N18 | C19 | H25 | 60.0° | 60.0° |
| N15 | C21 | C20 | N18 | 8.6° | 58.4° |
| N15 | C21 | C20 | H5 | 120.7° | 119.9° |
| N15 | C21 | C20 | H6 | 120.7° | 120.0° |
| N15 | C21 | C20 | H3 | 129.7° | 178.4° |
| N15 | C21 | C20 | H4 | 112.5° | 61.6° |
| N15 | C21 | H5 | H6 | 117.9° | 120.1° |
| C21 | N15 | C14 | H19 | 156.8° | 173.8° |
| C21 | N15 | C14 | H20 | 85.3° | 53.7° |
| C21 | N15 | C16 | H21 | 55.5° | 60.6° |
| C21 | N15 | C16 | H22 | 175.4° | 179.3° |
| C13 | C22 | C23 | H7 | 180.0° | 180.0° |
| C22 | C13 | C12 | C11 | 2.1° | 0.0° |
| C13 | C22 | C23 | C24 | 179.5° | 180.0° |
| C13 | C22 | C23 | C28 | 0.4° | 0.0° |
| C22 | C13 | C12 | H18 | 177.9° | 180.0° |
| C22 | C13 | C14 | H19 | 117.5° | 150.0° |
| C22 | C13 | C14 | H20 | 0.3° | 30.0° |
| C12 | C13 | C22 | C23 | 1.0° | 0.0° |
| C13 | C12 | C11 | H18 | 180.0° | 180.0° |
| C13 | C12 | C11 | C28 | 2.7° | 0.0° |
| C13 | C12 | C11 | N10 | 179.3° | 179.9° |
| C12 | C13 | C22 | H7 | 179.0° | 180.0° |
| C12 | C13 | C14 | H19 | 60.6° | 29.7° |
| C12 | C13 | C14 | H20 | 178.4° | 149.7° |
| C19 | N18 | C20 | C21 | 157.0° | 64.6° |
| C19 | N18 | C17 | H1 | 107.1° | 175.5° |
| C19 | N18 | C17 | H2 | 11.3° | 55.4° |
| C19 | N18 | C20 | H3 | 81.9° | 55.4° |
| C19 | N18 | C20 | H4 | 35.9° | 175.5° |
| N18 | C19 | H23 | H24 | 120.0° | 120.0° |
| N18 | C19 | H23 | H25 | 120.0° | 120.0° |
| N18 | C19 | H24 | H25 | 120.0° | 120.0° |
| N18 | C20 | C21 | H3 | 121.1° | 120.0° |
| N18 | C20 | C21 | H4 | 121.1° | 120.0° |
| C20 | N18 | C17 | H1 | 125.2° | 60.6° |
| C20 | N18 | C17 | H2 | 116.4° | 179.3° |
| N18 | C20 | H3 | H4 | 116.5° | 120.1° |
| N18 | C20 | C21 | H5 | 129.3° | 178.3° |
| N18 | C20 | C21 | H6 | 112.1° | 61.6° |
| C20 | N18 | C19 | H23 | 48.0° | 63.8° |
| C20 | N18 | C19 | H24 | 168.0° | 56.2° |
| C20 | N18 | C19 | H25 | 72.0° | 176.2° |
| C22 | C23 | C24 | F27 | 22.4° | 29.9° |
| C22 | C23 | C24 | C28 | 179.9° | 180.0° |
| C22 | C23 | C28 | C11 | 0.9° | 0.0° |
| C22 | C23 | C24 | F25 | 141.9° | 90.0° |
| C22 | C23 | C24 | F26 | 98.7° | 150.0° |
| C22 | C23 | C28 | H8 | 179.1° | 180.0° |
| C12 | C11 | C28 | C23 | 2.1° | 0.0° |
| C12 | C11 | C28 | N10 | 176.7° | 179.9° |
| C12 | C11 | N10 | C08 | 146.7° | 145.0° |
| C12 | C11 | C28 | H8 | 177.9° | 180.0° |
| C12 | C11 | N10 | H31 | 33.3° | 35.1° |
| C21 | C20 | H3 | H4 | 116.5° | 120.0° |
| C20 | C21 | H5 | H6 | 117.9° | 120.1° |
| F27 | C24 | C23 | F25 | 119.5° | 120.0° |
| F27 | C24 | C23 | F26 | 121.1° | 120.0° |
| F27 | C24 | C23 | C28 | 157.7° | 150.0° |
| F27 | C24 | F25 | F26 | 119.5° | 120.0° |
| C24 | C23 | C28 | C11 | 179.0° | 180.0° |
| C23 | C24 | F25 | F26 | 120.6° | 120.0° |
| C24 | C23 | C22 | H7 | 0.5° | 0.0° |
| C24 | C23 | C28 | H8 | 1.0° | 0.1° |
| C23 | C28 | C11 | H8 | 180.0° | 179.9° |
| C23 | C28 | C11 | N10 | 178.8° | 179.9° |
| C28 | C23 | C24 | F25 | 38.2° | 90.0° |
| C28 | C23 | C24 | F26 | 81.2° | 30.0° |
| C28 | C23 | C22 | H7 | 179.6° | 180.0° |
| C28 | C11 | N10 | C08 | 36.6° | 35.1° |
| C28 | C11 | C12 | H18 | 177.3° | 180.0° |
| C28 | C11 | N10 | H31 | 143.3° | 144.8° |
| C11 | N10 | C08 | H31 | 180.0° | 179.9° |
| C11 | N10 | C08 | C07 | 177.9° | 175.3° |
| C11 | N10 | C08 | O09 | 0.4° | 4.6° |
| N10 | C11 | C28 | H8 | 1.2° | 0.1° |
| N10 | C11 | C12 | H18 | 0.7° | 0.1° |
| N10 | C08 | C07 | C06 | 8.9° | 0.1° |
| N10 | C08 | C07 | O09 | 177.5° | 179.9° |
| N10 | C08 | C07 | C29 | 168.8° | 180.0° |
| C05 | C06 | C07 | H17 | 180.0° | 180.0° |
| C06 | C05 | C04 | H16 | 180.0° | 180.0° |
| C05 | C06 | C07 | C08 | 178.9° | 180.0° |
| C05 | C06 | C07 | C29 | 1.3° | 0.1° |
| C06 | C05 | C04 | C02 | 179.4° | 180.0° |
| C06 | C05 | C04 | C30 | 0.1° | 0.3° |
| C07 | C06 | C05 | C04 | 0.7° | 0.0° |
| C06 | C07 | C08 | C29 | 177.7° | 180.0° |
| C06 | C07 | C08 | O09 | 173.5° | 180.0° |
| C06 | C07 | C29 | C30 | 0.9° | 0.3° |
| C07 | C06 | C05 | H16 | 179.2° | 180.0° |
| C06 | C07 | C29 | H26 | 179.0° | 179.9° |
| C05 | C04 | C02 | C03 | 40.7° | 60.3° |
| C05 | C04 | C02 | C30 | 179.4° | 179.7° |
| C05 | C04 | C30 | C29 | 0.4° | 0.5° |
| C05 | C04 | C02 | C01 | 85.7° | 59.7° |
| C05 | C04 | C30 | C31 | 179.7° | 179.8° |
| C05 | C04 | C02 | H12 | 156.9° | 179.7° |
| C04 | C05 | C06 | H17 | 179.3° | 180.0° |
| C08 | C07 | C29 | C30 | 178.7° | 179.7° |
| C08 | C07 | C06 | H17 | 1.1° | 0.0° |
| C08 | C07 | C29 | H26 | 1.3° | 0.0° |
| C07 | C08 | N10 | H31 | 2.1° | 4.7° |
| O09 | C08 | C07 | C29 | 8.7° | 0.1° |
| O09 | C08 | N10 | H31 | 179.5° | 175.4° |
| C03 | C02 | C04 | C01 | 126.4° | 120.0° |
| C03 | C02 | C04 | H12 | 116.2° | 120.0° |
| C03 | C02 | C04 | C30 | 138.7° | 120.0° |
| C03 | C02 | C01 | H12 | 117.2° | 120.0° |
| C03 | C02 | C01 | H9 | 180.0° | 60.0° |
| C03 | C02 | C01 | H10 | 60.0° | 60.0° |
| C03 | C02 | C01 | H11 | 60.0° | 180.0° |
| C02 | C03 | H13 | H14 | 120.0° | 120.0° |
| C02 | C03 | H13 | H15 | 120.0° | 120.0° |
| C02 | C03 | H14 | H15 | 120.0° | 119.9° |
| C07 | C29 | C30 | C04 | 0.1° | 0.5° |
| C07 | C29 | C30 | H26 | 180.0° | 179.8° |
| C07 | C29 | C30 | C31 | 179.8° | 179.8° |
| C29 | C07 | C06 | H17 | 178.7° | 180.0° |
| C02 | C04 | C30 | C29 | 179.8° | 179.8° |
| C04 | C02 | C01 | H12 | 117.2° | 120.0° |
| C02 | C04 | C30 | C31 | 0.3° | 0.0° |
| C04 | C02 | C01 | H9 | 54.4° | 60.0° |
| C04 | C02 | C01 | H10 | 65.6° | 180.0° |
| C04 | C02 | C01 | H11 | 174.4° | 60.0° |
| C04 | C02 | C03 | H13 | 180.0° | 60.0° |
| C04 | C02 | C03 | H14 | 60.0° | 60.0° |
| C04 | C02 | C03 | H15 | 60.0° | 180.0° |
| C02 | C04 | C05 | H16 | 0.6° | 0.0° |
| C04 | C30 | C29 | C31 | 180.0° | 179.7° |
| C30 | C04 | C02 | C01 | 94.9° | 120.0° |
| C04 | C30 | C31 | C32 | 177.5° | 64.1° |
| C30 | C04 | C02 | H12 | 22.5° | 0.0° |
| C30 | C04 | C05 | H16 | 180.0° | 179.8° |
| C04 | C30 | C29 | H26 | 179.8° | 179.7° |
| C29 | C30 | C31 | C32 | 2.5° | 116.2° |
| C02 | C01 | H9 | H10 | 120.0° | 120.1° |
| C02 | C01 | H9 | H11 | 120.0° | 120.0° |
| C02 | C01 | H10 | H11 | 120.0° | 120.1° |
| C01 | C02 | C03 | H13 | 53.2° | 60.0° |
| C01 | C02 | C03 | H14 | 66.8° | 179.9° |
| C01 | C02 | C03 | H15 | 173.2° | 60.0° |
| C30 | C31 | C32 | C33 | 75.7° | 169.5° |
| C31 | C30 | C29 | H26 | 0.2° | 0.0° |
| C31 | C32 | C33 | C34 | 0.6° | 53.5° |
| C31 | C32 | C33 | N41 | 178.6° | 126.8° |
| C32 | C33 | C34 | N41 | 179.4° | 179.8° |
| C32 | C33 | C34 | N35 | 179.7° | 180.0° |
| C32 | C33 | N41 | C40 | 0.5° | 0.0° |
| C32 | C33 | N41 | C36 | 179.7° | 179.8° |
| C32 | C33 | C34 | H27 | 0.4° | 0.0° |
| C33 | C34 | N35 | H27 | 180.0° | 180.0° |
| C34 | C33 | N41 | C40 | 179.9° | 179.8° |
| C34 | C33 | N41 | C36 | 0.3° | 0.4° |
| C33 | C34 | N35 | C36 | 0.2° | 0.0° |
| N41 | C33 | C34 | N35 | 0.3° | 0.2° |
| C33 | N41 | C40 | C36 | 179.8° | 179.8° |
| C33 | N41 | C36 | N35 | 0.2° | 0.4° |
| C33 | N41 | C40 | C39 | 179.8° | 180.0° |
| C33 | N41 | C36 | C37 | 179.7° | 179.9° |
| N41 | C33 | C34 | H27 | 179.7° | 179.7° |
| C33 | N41 | C40 | H30 | 0.2° | 0.6° |
| C34 | N35 | C36 | N41 | 0.0° | 0.3° |
| C34 | N35 | C36 | C37 | 179.9° | 179.9° |
| C40 | N41 | C36 | N35 | 180.0° | 179.7° |
| N41 | C40 | C39 | H30 | 180.0° | 179.4° |
| C40 | N41 | C36 | C37 | 0.1° | 0.0° |
| N41 | C40 | C39 | N38 | 0.1° | 0.7° |
| N41 | C40 | C39 | H29 | 179.9° | 179.7° |
| N41 | C36 | N35 | C37 | 179.9° | 179.7° |
| C36 | N41 | C40 | C39 | 0.0° | 0.2° |
| N41 | C36 | C37 | N38 | 0.1° | 0.3° |
| N41 | C36 | C37 | H28 | 179.9° | 179.7° |
| C36 | N41 | C40 | H30 | 180.0° | 179.6° |
| N35 | C36 | C37 | N38 | 180.0° | 179.9° |
| C36 | N35 | C34 | H27 | 179.9° | 180.0° |
| N35 | C36 | C37 | H28 | 0.0° | 0.1° |
| C40 | C39 | N38 | H29 | 180.0° | 179.0° |
| C40 | C39 | N38 | C37 | 0.1° | 1.0° |
| C36 | C37 | N38 | C39 | 0.0° | 0.8° |
| C36 | C37 | N38 | H28 | 180.0° | 180.0° |
| C39 | N38 | C37 | H28 | 180.0° | 179.3° |
| N38 | C39 | C40 | H30 | 179.9° | 179.9° |
| C37 | N38 | C39 | H29 | 179.9° | 180.0° |
| H1 | C17 | C16 | H21 | 161.8° | 178.4° |
| H1 | C17 | C16 | H22 | 41.9° | 58.4° |
| H2 | C17 | C16 | H21 | 43.5° | 58.5° |
| H2 | C17 | C16 | H22 | 76.5° | 61.6° |
| H3 | C20 | C21 | H5 | 109.6° | 61.7° |
| H3 | C20 | C21 | H6 | 9.0° | 58.4° |
| H4 | C20 | C21 | H5 | 8.2° | 58.3° |
| H4 | C20 | C21 | H6 | 126.8° | 178.4° |
| H9 | C01 | H10 | H11 | 120.0° | 119.9° |
| H9 | C01 | C02 | H12 | 62.9° | 180.0° |
| H10 | C01 | C02 | H12 | 177.2° | 60.0° |
| H11 | C01 | C02 | H12 | 57.2° | 60.0° |
| H12 | C02 | C03 | H13 | 64.0° | 180.0° |
| H12 | C02 | C03 | H14 | 176.0° | 60.0° |
| H12 | C02 | C03 | H15 | 56.0° | 60.0° |
| H13 | C03 | H14 | H15 | 120.0° | 120.1° |
| H16 | C05 | C06 | H17 | 0.8° | 0.0° |
| H23 | C19 | H24 | H25 | 120.0° | 120.0° |
| H29 | C39 | C40 | H30 | 0.1° | 0.9° |
