P46
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O09 | S07 | doub | 1.42Å | 1.42Å | |
| C06 | C05 | doub | 1.38Å | 1.38Å | Aromatic |
| C06 | C01 | sing | 1.39Å | 1.39Å | Aromatic |
| C05 | C04 | sing | 1.38Å | 1.40Å | Aromatic |
| O35 | C01 | sing | 1.36Å | 1.35Å | |
| C01 | C02 | doub | 1.39Å | 1.40Å | Aromatic |
| S07 | C04 | sing | 1.76Å | 1.68Å | |
| S07 | O08 | doub | 1.42Å | 1.42Å | |
| S07 | N10 | sing | 1.66Å | 1.65Å | |
| C04 | C03 | doub | 1.39Å | 1.41Å | Aromatic |
| C14 | N10 | sing | 1.35Å | 1.52Å | Aromatic |
| C14 | C13 | doub | 1.38Å | 1.51Å | Aromatic |
| N10 | C11 | sing | 1.36Å | 1.48Å | Aromatic |
| C13 | C15 | sing | 1.41Å | 1.40Å | Aromatic |
| C13 | C12 | sing | 1.48Å | 1.39Å | Aromatic |
| C03 | C02 | sing | 1.39Å | 1.40Å | Aromatic |
| C03 | O34 | sing | 1.36Å | 1.39Å | |
| C15 | C16 | doub | 1.35Å | 1.41Å | Aromatic |
| C11 | C12 | doub | 1.37Å | 1.53Å | Aromatic |
| C12 | C18 | sing | 1.41Å | 1.38Å | Aromatic |
| C16 | C17 | sing | 1.40Å | 1.40Å | Aromatic |
| C18 | C17 | doub | 1.36Å | 1.44Å | Aromatic |
| C17 | N19 | sing | 1.40Å | 1.42Å | |
| N19 | C20 | sing | 1.47Å | 1.45Å | |
| C20 | C21 | sing | 1.53Å | 1.57Å | |
| C20 | C25 | sing | 1.53Å | 1.56Å | |
| C21 | C22 | sing | 1.53Å | 1.52Å | |
| C22 | N23 | sing | 1.47Å | 1.48Å | |
| O30 | C29 | doub | 1.21Å | 1.23Å | |
| C25 | C24 | sing | 1.53Å | 1.53Å | |
| N31 | C29 | sing | 1.35Å | 1.39Å | |
| C24 | N23 | sing | 1.47Å | 1.47Å | |
| N23 | C26 | sing | 1.35Å | 1.40Å | |
| C29 | C28 | sing | 1.51Å | 1.51Å | |
| C26 | C27 | sing | 1.51Å | 1.58Å | |
| C26 | O33 | doub | 1.21Å | 1.24Å | |
| C27 | C28 | sing | 1.53Å | 1.57Å | |
| C27 | N32 | sing | 1.47Å | 1.46Å | |
| C02 | H1 | sing | 1.08Å | 1.08Å | |
| C05 | H2 | sing | 1.08Å | 1.08Å | |
| C11 | H3 | sing | 1.08Å | 1.08Å | |
| C14 | H4 | sing | 1.08Å | 1.08Å | |
| C15 | H5 | sing | 1.08Å | 1.08Å | |
| C06 | H6 | sing | 1.08Å | 1.08Å | |
| C16 | H7 | sing | 1.08Å | 1.08Å | |
| C18 | H8 | sing | 1.08Å | 1.08Å | |
| N19 | H9 | sing | 0.97Å | 1.00Å | |
| C20 | H10 | sing | 1.09Å | 1.10Å | |
| C21 | H11 | sing | 1.09Å | 1.10Å | |
| C21 | H12 | sing | 1.09Å | 1.10Å | |
| C22 | H13 | sing | 1.09Å | 1.10Å | |
| C22 | H14 | sing | 1.09Å | 1.10Å | |
| C24 | H15 | sing | 1.09Å | 1.10Å | |
| C24 | H16 | sing | 1.09Å | 1.10Å | |
| C25 | H17 | sing | 1.09Å | 1.10Å | |
| C25 | H18 | sing | 1.09Å | 1.10Å | |
| C27 | H19 | sing | 1.09Å | 1.10Å | |
| C28 | H20 | sing | 1.09Å | 1.10Å | |
| C28 | H21 | sing | 1.09Å | 1.10Å | |
| N31 | H22 | sing | 0.97Å | 1.00Å | |
| N31 | H23 | sing | 0.97Å | 1.00Å | |
| N32 | H24 | sing | 1.01Å | 1.00Å | |
| N32 | H25 | sing | 1.01Å | 1.00Å | |
| O34 | H27 | sing | 0.97Å | 0.95Å | |
| O35 | H28 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O09 | S07 | C04 | 107.9° | 106.4° |
| O09 | S07 | O08 | 120.2° | 123.2° |
| O09 | S07 | N10 | 104.2° | 106.4° |
| C05 | C06 | C01 | 119.0° | 120.0° |
| C06 | C05 | C04 | 124.0° | 120.2° |
| C06 | C05 | H2 | 118.0° | 119.9° |
| C05 | C06 | H6 | 120.5° | 120.0° |
| C06 | C01 | O35 | 119.5° | 120.1° |
| C06 | C01 | C02 | 120.6° | 120.0° |
| C01 | C06 | H6 | 120.5° | 120.0° |
| C05 | C04 | S07 | 120.6° | 120.0° |
| C05 | C04 | C03 | 114.5° | 120.0° |
| C04 | C05 | H2 | 118.0° | 119.9° |
| O35 | C01 | C02 | 119.9° | 120.0° |
| C01 | O35 | H28 | 109.5° | 114.0° |
| C01 | C02 | C03 | 117.8° | 119.9° |
| C01 | C02 | H1 | 121.1° | 120.1° |
| C04 | S07 | O08 | 108.7° | 106.4° |
| C04 | S07 | N10 | 109.1° | 107.2° |
| S07 | C04 | C03 | 124.8° | 120.0° |
| O08 | S07 | N10 | 106.3° | 106.4° |
| S07 | N10 | C14 | 121.7° | 124.5° |
| S07 | N10 | C11 | 124.0° | 124.5° |
| C04 | C03 | C02 | 123.9° | 120.0° |
| C04 | C03 | O34 | 116.5° | 120.0° |
| N10 | C14 | C13 | 106.5° | 108.7° |
| C14 | N10 | C11 | 106.5° | 110.9° |
| N10 | C14 | H4 | 126.7° | 125.7° |
| C14 | C13 | C15 | 130.2° | 135.3° |
| C14 | C13 | C12 | 110.1° | 105.9° |
| C13 | C14 | H4 | 126.7° | 125.7° |
| N10 | C11 | C12 | 107.5° | 108.6° |
| N10 | C11 | H3 | 126.3° | 125.7° |
| C15 | C13 | C12 | 119.7° | 118.7° |
| C13 | C15 | C16 | 120.0° | 119.6° |
| C13 | C15 | H5 | 120.0° | 120.2° |
| C13 | C12 | C11 | 108.8° | 105.9° |
| C13 | C12 | C18 | 120.7° | 118.7° |
| C02 | C03 | O34 | 119.6° | 120.1° |
| C03 | C02 | H1 | 121.1° | 120.0° |
| C03 | O34 | H27 | 109.5° | 114.0° |
| C15 | C16 | C17 | 121.2° | 121.9° |
| C16 | C15 | H5 | 120.0° | 120.2° |
| C15 | C16 | H7 | 119.4° | 119.1° |
| C11 | C12 | C18 | 130.5° | 135.4° |
| C12 | C11 | H3 | 126.3° | 125.7° |
| C12 | C18 | C17 | 121.0° | 119.4° |
| C12 | C18 | H8 | 119.5° | 120.3° |
| C16 | C17 | C18 | 117.4° | 121.7° |
| C16 | C17 | N19 | 124.1° | 119.2° |
| C17 | C16 | H7 | 119.4° | 119.0° |
| C18 | C17 | N19 | 118.6° | 119.1° |
| C17 | C18 | H8 | 119.5° | 120.3° |
| C17 | N19 | C20 | 126.3° | 120.0° |
| C17 | N19 | H9 | 105.1° | 120.0° |
| N19 | C20 | C21 | 115.5° | 109.5° |
| N19 | C20 | C25 | 113.7° | 109.4° |
| C20 | N19 | H9 | 105.1° | 120.0° |
| N19 | C20 | H10 | 108.0° | 109.5° |
| C21 | C20 | C25 | 105.7° | 109.5° |
| C20 | C21 | C22 | 114.6° | 109.3° |
| C21 | C20 | H10 | 106.7° | 109.5° |
| C20 | C21 | H11 | 108.2° | 109.5° |
| C20 | C21 | H12 | 108.2° | 109.4° |
| C20 | C25 | C24 | 115.6° | 109.3° |
| C25 | C20 | H10 | 106.7° | 109.4° |
| C20 | C25 | H17 | 107.9° | 109.5° |
| C20 | C25 | H18 | 107.9° | 109.5° |
| C21 | C22 | N23 | 112.5° | 108.8° |
| C22 | C21 | H11 | 108.2° | 109.5° |
| C22 | C21 | H12 | 108.2° | 109.5° |
| C21 | C22 | H13 | 108.7° | 109.6° |
| C21 | C22 | H14 | 108.7° | 109.6° |
| C22 | N23 | C24 | 110.5° | 118.7° |
| C22 | N23 | C26 | 123.2° | 120.6° |
| N23 | C22 | H13 | 108.7° | 109.5° |
| N23 | C22 | H14 | 108.7° | 109.6° |
| O30 | C29 | N31 | 118.8° | 120.0° |
| O30 | C29 | C28 | 122.6° | 120.0° |
| C25 | C24 | N23 | 110.9° | 108.8° |
| C25 | C24 | H15 | 109.1° | 109.6° |
| C25 | C24 | H16 | 109.1° | 109.7° |
| C24 | C25 | H17 | 107.9° | 109.5° |
| C24 | C25 | H18 | 107.9° | 109.5° |
| N31 | C29 | C28 | 118.6° | 120.0° |
| C29 | N31 | H22 | 120.0° | 120.0° |
| C29 | N31 | H23 | 120.0° | 120.0° |
| C24 | N23 | C26 | 126.3° | 120.7° |
| N23 | C24 | H15 | 109.1° | 109.5° |
| N23 | C24 | H16 | 109.1° | 109.6° |
| N23 | C26 | C27 | 125.0° | 120.0° |
| N23 | C26 | O33 | 117.2° | 120.0° |
| C29 | C28 | C27 | 111.2° | 109.5° |
| C29 | C28 | H20 | 109.0° | 109.5° |
| C29 | C28 | H21 | 109.1° | 109.5° |
| C27 | C26 | O33 | 117.8° | 120.0° |
| C26 | C27 | C28 | 112.1° | 109.5° |
| C26 | C27 | N32 | 108.3° | 109.5° |
| C26 | C27 | H19 | 108.0° | 109.5° |
| C28 | C27 | N32 | 110.6° | 109.5° |
| C28 | C27 | H19 | 108.1° | 109.4° |
| C27 | C28 | H20 | 109.1° | 109.5° |
| C27 | C28 | H21 | 109.0° | 109.5° |
| N32 | C27 | H19 | 109.6° | 109.5° |
| C27 | N32 | H24 | 109.5° | 111.0° |
| C27 | N32 | H25 | 109.5° | 111.0° |
| H11 | C21 | H12 | 109.4° | 109.5° |
| H13 | C22 | H14 | 109.5° | 109.7° |
| H15 | C24 | H16 | 109.5° | 109.6° |
| H17 | C25 | H18 | 109.5° | 109.5° |
| H20 | C28 | H21 | 109.5° | 109.4° |
| H22 | N31 | H23 | 120.0° | 120.0° |
| H24 | N32 | H25 | 109.4° | 111.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O09 | S07 | C04 | C05 | 1.3° | 131.4° |
| O09 | S07 | C04 | O08 | 131.8° | 132.9° |
| O09 | S07 | C04 | N10 | 112.7° | 113.5° |
| O09 | S07 | O08 | N10 | 117.8° | 123.0° |
| O09 | S07 | C04 | C03 | 177.9° | 48.5° |
| O09 | S07 | N10 | C14 | 66.7° | 23.6° |
| O09 | S07 | N10 | C11 | 78.3° | 156.0° |
| C05 | C06 | C01 | H6 | 180.0° | 180.0° |
| C06 | C05 | C04 | H2 | 180.0° | 179.9° |
| C05 | C06 | C01 | O35 | 179.9° | 179.7° |
| C05 | C06 | C01 | C02 | 0.6° | 0.0° |
| C06 | C05 | C04 | S07 | 179.0° | 180.0° |
| C06 | C05 | C04 | C03 | 2.1° | 0.0° |
| C01 | C06 | C05 | C04 | 0.4° | 0.1° |
| C06 | C01 | O35 | C02 | 179.5° | 179.7° |
| C06 | C01 | C02 | C03 | 0.2° | 0.0° |
| C06 | C01 | C02 | H1 | 179.8° | 179.9° |
| C01 | C06 | C05 | H2 | 179.6° | 179.9° |
| C06 | C01 | O35 | H28 | 180.0° | 90.2° |
| C05 | C04 | S07 | C03 | 176.6° | 180.0° |
| C05 | C04 | S07 | O08 | 133.1° | 1.5° |
| C05 | C04 | S07 | N10 | 111.4° | 115.0° |
| C05 | C04 | C03 | C02 | 2.9° | 0.0° |
| C05 | C04 | C03 | O34 | 179.0° | 180.0° |
| C04 | C05 | C06 | H6 | 179.6° | 180.0° |
| O35 | C01 | C02 | C03 | 179.3° | 179.7° |
| O35 | C01 | C02 | H1 | 0.7° | 0.3° |
| O35 | C01 | C06 | H6 | 0.1° | 0.3° |
| C01 | C02 | C03 | C04 | 2.1° | 0.0° |
| C01 | C02 | C03 | H1 | 180.0° | 179.9° |
| C01 | C02 | C03 | O34 | 179.9° | 180.0° |
| C02 | C01 | C06 | H6 | 179.4° | 180.0° |
| C02 | C01 | O35 | H28 | 0.5° | 90.1° |
| C04 | S07 | O08 | N10 | 117.3° | 114.1° |
| C04 | S07 | N10 | C14 | 48.3° | 89.9° |
| C04 | S07 | N10 | C11 | 166.7° | 90.5° |
| S07 | C04 | C03 | C02 | 179.7° | 180.0° |
| S07 | C04 | C03 | O34 | 2.2° | 0.0° |
| S07 | C04 | C05 | H2 | 1.0° | 0.1° |
| O08 | S07 | C04 | C03 | 50.3° | 178.5° |
| O08 | S07 | N10 | C14 | 165.4° | 156.5° |
| O08 | S07 | N10 | C11 | 49.6° | 23.1° |
| N10 | S07 | C04 | C03 | 65.2° | 65.0° |
| S07 | N10 | C14 | C11 | 150.3° | 179.6° |
| S07 | N10 | C14 | C13 | 157.7° | 180.0° |
| S07 | N10 | C11 | C12 | 157.0° | 180.0° |
| S07 | N10 | C11 | H3 | 23.0° | 0.2° |
| S07 | N10 | C14 | H4 | 22.4° | 0.3° |
| C04 | C03 | C02 | O34 | 178.0° | 180.0° |
| C04 | C03 | C02 | H1 | 177.9° | 180.0° |
| C03 | C04 | C05 | H2 | 177.9° | 179.9° |
| C04 | C03 | O34 | H27 | 19.2° | 90.0° |
| N10 | C14 | C13 | H4 | 180.0° | 179.7° |
| N10 | C14 | C13 | C15 | 175.3° | 179.8° |
| N10 | C14 | C13 | C12 | 4.4° | 0.3° |
| C14 | N10 | C11 | C12 | 7.6° | 0.3° |
| C14 | N10 | C11 | H3 | 172.4° | 179.8° |
| C13 | C14 | N10 | C11 | 7.4° | 0.4° |
| C14 | C13 | C15 | C12 | 179.7° | 180.0° |
| C14 | C13 | C15 | C16 | 179.7° | 180.0° |
| C14 | C13 | C12 | C11 | 0.3° | 0.1° |
| C14 | C13 | C12 | C18 | 179.9° | 180.0° |
| C14 | C13 | C15 | H5 | 0.3° | 0.1° |
| N10 | C11 | C12 | C13 | 5.0° | 0.2° |
| N10 | C11 | C12 | H3 | 180.0° | 179.8° |
| N10 | C11 | C12 | C18 | 175.2° | 179.7° |
| C11 | N10 | C14 | H4 | 172.6° | 180.0° |
| C13 | C15 | C16 | H5 | 180.0° | 179.9° |
| C15 | C13 | C12 | C11 | 180.0° | 180.0° |
| C15 | C13 | C12 | C18 | 0.1° | 0.0° |
| C13 | C15 | C16 | C17 | 0.1° | 0.0° |
| C15 | C13 | C14 | H4 | 4.7° | 0.1° |
| C13 | C15 | C16 | H7 | 179.9° | 180.0° |
| C12 | C13 | C15 | C16 | 0.0° | 0.1° |
| C13 | C12 | C11 | C18 | 179.8° | 179.9° |
| C13 | C12 | C18 | C17 | 0.4° | 0.0° |
| C13 | C12 | C11 | H3 | 175.0° | 180.0° |
| C12 | C13 | C14 | H4 | 175.6° | 179.9° |
| C12 | C13 | C15 | H5 | 180.0° | 180.0° |
| C13 | C12 | C18 | H8 | 179.6° | 180.0° |
| C02 | C03 | O34 | H27 | 159.0° | 89.9° |
| O34 | C03 | C02 | H1 | 0.1° | 0.0° |
| C15 | C16 | C17 | H7 | 180.0° | 180.0° |
| C15 | C16 | C17 | C18 | 0.3° | 0.1° |
| C15 | C16 | C17 | N19 | 179.5° | 179.9° |
| C11 | C12 | C18 | C17 | 179.8° | 179.9° |
| C11 | C12 | C18 | H8 | 0.2° | 0.1° |
| C12 | C18 | C17 | C16 | 0.5° | 0.1° |
| C12 | C18 | C17 | H8 | 180.0° | 179.9° |
| C12 | C18 | C17 | N19 | 179.7° | 180.0° |
| C18 | C12 | C11 | H3 | 4.8° | 0.1° |
| C16 | C17 | C18 | N19 | 179.3° | 179.9° |
| C16 | C17 | N19 | C20 | 172.4° | 0.1° |
| C17 | C16 | C15 | H5 | 179.9° | 179.9° |
| C16 | C17 | C18 | H8 | 179.5° | 180.0° |
| C16 | C17 | N19 | H9 | 65.3° | 180.0° |
| C18 | C17 | N19 | C20 | 6.8° | 180.0° |
| C18 | C17 | C16 | H7 | 179.7° | 179.9° |
| C18 | C17 | N19 | H9 | 115.5° | 0.2° |
| C17 | N19 | C20 | H9 | 122.3° | 179.9° |
| C17 | N19 | C20 | C21 | 159.8° | 155.0° |
| C17 | N19 | C20 | C25 | 77.7° | 85.0° |
| N19 | C17 | C16 | H7 | 0.5° | 0.1° |
| N19 | C17 | C18 | H8 | 0.3° | 0.1° |
| C17 | N19 | C20 | H10 | 40.5° | 35.0° |
| N19 | C20 | C21 | C25 | 126.6° | 120.0° |
| N19 | C20 | C21 | H10 | 120.1° | 120.0° |
| N19 | C20 | C25 | H10 | 119.0° | 120.0° |
| N19 | C20 | C21 | C22 | 174.7° | 178.6° |
| N19 | C20 | C25 | C24 | 177.2° | 178.7° |
| N19 | C20 | C21 | H11 | 53.9° | 61.4° |
| N19 | C20 | C21 | H12 | 64.5° | 58.7° |
| N19 | C20 | C25 | H17 | 61.9° | 58.7° |
| N19 | C20 | C25 | H18 | 56.3° | 61.4° |
| C21 | C20 | C25 | H10 | 113.3° | 120.0° |
| C20 | C21 | C22 | H11 | 120.8° | 120.0° |
| C20 | C21 | C22 | H12 | 120.8° | 119.9° |
| C20 | C21 | C22 | N23 | 55.1° | 54.7° |
| C21 | C20 | C25 | C24 | 49.5° | 61.4° |
| C21 | C20 | N19 | H9 | 77.9° | 24.9° |
| C20 | C21 | H11 | H12 | 117.7° | 120.0° |
| C20 | C21 | C22 | H13 | 175.5° | 174.4° |
| C20 | C21 | C22 | H14 | 65.4° | 65.1° |
| C21 | C20 | C25 | H17 | 170.4° | 178.7° |
| C21 | C20 | C25 | H18 | 71.4° | 58.6° |
| C25 | C20 | C21 | C22 | 48.1° | 61.4° |
| C20 | C25 | C24 | H17 | 120.9° | 120.0° |
| C20 | C25 | C24 | H18 | 120.9° | 120.0° |
| C20 | C25 | C24 | N23 | 56.8° | 54.7° |
| C25 | C20 | N19 | H9 | 44.5° | 95.1° |
| C25 | C20 | C21 | H11 | 72.7° | 58.6° |
| C25 | C20 | C21 | H12 | 168.9° | 178.7° |
| C20 | C25 | C24 | H15 | 63.4° | 174.4° |
| C20 | C25 | C24 | H16 | 177.0° | 65.2° |
| C20 | C25 | H17 | H18 | 117.2° | 120.1° |
| C21 | C22 | N23 | H13 | 120.4° | 119.8° |
| C21 | C22 | N23 | H14 | 120.5° | 119.8° |
| C21 | C22 | N23 | C24 | 57.9° | 53.6° |
| C21 | C22 | N23 | C26 | 121.5° | 126.3° |
| C22 | C21 | C20 | H10 | 65.2° | 58.6° |
| C22 | C21 | H11 | H12 | 117.6° | 120.1° |
| C21 | C22 | H13 | H14 | 118.6° | 120.4° |
| C22 | N23 | C24 | C25 | 57.9° | 53.6° |
| C22 | N23 | C24 | C26 | 179.4° | 179.9° |
| C22 | N23 | C26 | C27 | 0.8° | 180.0° |
| C22 | N23 | C26 | O33 | 179.9° | 0.0° |
| N23 | C22 | C21 | H11 | 65.7° | 65.3° |
| N23 | C22 | C21 | H12 | 175.9° | 174.6° |
| N23 | C22 | H13 | H14 | 118.6° | 120.3° |
| C22 | N23 | C24 | H15 | 62.3° | 173.4° |
| C22 | N23 | C24 | H16 | 178.1° | 66.4° |
| O30 | C29 | N31 | C28 | 179.1° | 180.0° |
| O30 | C29 | C28 | C27 | 109.7° | 0.0° |
| O30 | C29 | C28 | H20 | 10.5° | 120.0° |
| O30 | C29 | C28 | H21 | 130.0° | 120.0° |
| O30 | C29 | N31 | H22 | 0.0° | 180.0° |
| O30 | C29 | N31 | H23 | 180.0° | 0.0° |
| C25 | C24 | N23 | H15 | 120.2° | 119.8° |
| C25 | C24 | N23 | H16 | 120.2° | 120.0° |
| C25 | C24 | N23 | C26 | 121.5° | 126.3° |
| C24 | C25 | C20 | H10 | 63.8° | 58.6° |
| C25 | C24 | H15 | H16 | 119.3° | 120.4° |
| C24 | C25 | H17 | H18 | 117.2° | 120.1° |
| N31 | C29 | C28 | C27 | 69.3° | 180.0° |
| N31 | C29 | C28 | H20 | 170.4° | 59.9° |
| N31 | C29 | C28 | H21 | 50.9° | 60.0° |
| C29 | N31 | H22 | H23 | 180.0° | 180.0° |
| C24 | N23 | C26 | C27 | 179.8° | 0.1° |
| C24 | N23 | C26 | O33 | 0.5° | 180.0° |
| C24 | N23 | C22 | H13 | 178.4° | 173.4° |
| C24 | N23 | C22 | H14 | 62.5° | 66.2° |
| N23 | C24 | H15 | H16 | 119.3° | 120.2° |
| N23 | C24 | C25 | H17 | 177.7° | 174.6° |
| N23 | C24 | C25 | H18 | 64.1° | 65.3° |
| N23 | C26 | C27 | O33 | 179.3° | 180.0° |
| N23 | C26 | C27 | C28 | 79.8° | 80.0° |
| N23 | C26 | C27 | N32 | 157.8° | 160.0° |
| C26 | N23 | C22 | H13 | 1.1° | 6.5° |
| C26 | N23 | C22 | H14 | 118.1° | 113.9° |
| C26 | N23 | C24 | H15 | 118.3° | 6.5° |
| C26 | N23 | C24 | H16 | 1.3° | 113.7° |
| N23 | C26 | C27 | H19 | 39.1° | 40.0° |
| C29 | C28 | C27 | C26 | 105.4° | 175.0° |
| C29 | C28 | C27 | H20 | 120.3° | 120.0° |
| C29 | C28 | C27 | H21 | 120.3° | 120.0° |
| C29 | C28 | C27 | N32 | 133.6° | 65.0° |
| C29 | C28 | C27 | H19 | 13.6° | 55.0° |
| C29 | C28 | H20 | H21 | 119.2° | 120.0° |
| C28 | C29 | N31 | H22 | 179.1° | 0.0° |
| C28 | C29 | N31 | H23 | 0.9° | 180.0° |
| C26 | C27 | C28 | N32 | 121.0° | 120.0° |
| C26 | C27 | C28 | H19 | 118.9° | 120.0° |
| C26 | C27 | N32 | H19 | 117.6° | 120.0° |
| C26 | C27 | C28 | H20 | 14.9° | 65.0° |
| C26 | C27 | C28 | H21 | 134.4° | 55.0° |
| C26 | C27 | N32 | H24 | 180.0° | 60.0° |
| C26 | C27 | N32 | H25 | 60.0° | 176.0° |
| O33 | C26 | C27 | C28 | 100.9° | 100.0° |
| O33 | C26 | C27 | N32 | 21.5° | 20.0° |
| O33 | C26 | C27 | H19 | 140.2° | 140.0° |
| C28 | C27 | N32 | H19 | 119.1° | 120.0° |
| C27 | C28 | H20 | H21 | 119.2° | 120.0° |
| C28 | C27 | N32 | H24 | 56.8° | 60.0° |
| C28 | C27 | N32 | H25 | 176.7° | 63.9° |
| N32 | C27 | C28 | H20 | 106.1° | 55.0° |
| N32 | C27 | C28 | H21 | 13.4° | 175.0° |
| C27 | N32 | H24 | H25 | 120.0° | 124.0° |
| H2 | C05 | C06 | H6 | 0.4° | 0.1° |
| H5 | C15 | C16 | H7 | 0.1° | 0.0° |
| H9 | N19 | C20 | H10 | 162.8° | 144.9° |
| H10 | C20 | C21 | H11 | 174.0° | 178.6° |
| H10 | C20 | C21 | H12 | 55.5° | 61.3° |
| H10 | C20 | C25 | H17 | 57.1° | 61.3° |
| H10 | C20 | C25 | H18 | 175.3° | 178.6° |
| H11 | C21 | C22 | H13 | 54.7° | 54.4° |
| H11 | C21 | C22 | H14 | 173.9° | 174.9° |
| H12 | C21 | C22 | H13 | 63.7° | 65.7° |
| H12 | C21 | C22 | H14 | 55.4° | 54.8° |
| H15 | C24 | C25 | H17 | 57.5° | 65.6° |
| H15 | C24 | C25 | H18 | 175.7° | 54.5° |
| H16 | C24 | C25 | H17 | 62.1° | 54.7° |
| H16 | C24 | C25 | H18 | 56.1° | 174.8° |
| H19 | C27 | C28 | H20 | 133.8° | 175.0° |
| H19 | C27 | C28 | H21 | 106.7° | 65.0° |
| H19 | C27 | N32 | H24 | 62.4° | 180.0° |
| H19 | C27 | N32 | H25 | 57.6° | 56.0° |
