7B6
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C27 | C19 | sing | 1.57Å | 1.50Å | |
| C27 | C10 | sing | 1.57Å | 1.48Å | |
| C19 | C18 | sing | 1.56Å | 1.54Å | |
| C19 | C20 | sing | 1.56Å | 1.52Å | |
| O16 | C15 | doub | 1.21Å | 1.22Å | |
| C18 | C8 | sing | 1.55Å | 1.54Å | |
| C18 | N17 | sing | 1.47Å | 1.48Å | |
| C10 | C8 | sing | 1.56Å | 1.54Å | |
| C10 | C26 | sing | 1.56Å | 1.54Å | |
| C20 | C26 | sing | 1.55Å | 1.54Å | |
| C15 | N17 | sing | 1.35Å | 1.34Å | |
| C15 | C14 | sing | 1.51Å | 1.51Å | |
| C23 | C24 | sing | 1.53Å | 1.54Å | |
| C23 | C22 | sing | 1.53Å | 1.54Å | |
| C24 | C25 | sing | 1.53Å | 1.55Å | |
| C14 | C21 | sing | 1.53Å | 1.56Å | |
| C14 | N13 | sing | 1.46Å | 1.51Å | |
| O12 | C11 | doub | 1.22Å | 1.24Å | |
| C21 | C22 | sing | 1.53Å | 1.54Å | |
| C22 | C29 | sing | 1.53Å | 1.55Å | |
| O9 | C7 | doub | 1.21Å | 1.23Å | |
| O8 | C7 | sing | 1.34Å | 1.27Å | |
| C25 | C28 | sing | 1.53Å | 1.55Å | |
| C11 | N13 | sing | 1.35Å | 1.35Å | |
| C11 | N10 | sing | 1.35Å | 1.35Å | |
| C7 | C6 | sing | 1.51Å | 1.54Å | |
| C29 | C28 | sing | 1.53Å | 1.57Å | |
| N10 | C6 | sing | 1.46Å | 1.51Å | |
| C6 | C5 | sing | 1.53Å | 1.57Å | |
| C5 | C4 | sing | 1.53Å | 1.54Å | |
| C4 | C3 | sing | 1.53Å | 1.53Å | |
| N1 | C2 | sing | 1.47Å | 1.48Å | |
| C3 | C2 | sing | 1.53Å | 1.52Å | |
| C2 | H1 | sing | 1.09Å | 1.10Å | |
| C2 | H2 | sing | 1.09Å | 1.10Å | |
| C3 | H3 | sing | 1.09Å | 1.10Å | |
| C3 | H4 | sing | 1.09Å | 1.10Å | |
| C8 | H5 | sing | 1.09Å | 1.10Å | |
| C8 | H6 | sing | 1.09Å | 1.10Å | |
| C10 | H7 | sing | 1.09Å | 1.10Å | |
| C14 | H8 | sing | 1.09Å | 1.10Å | |
| C19 | H9 | sing | 1.09Å | 1.10Å | |
| C20 | H10 | sing | 1.09Å | 1.10Å | |
| C20 | H11 | sing | 1.09Å | 1.10Å | |
| C21 | H12 | sing | 1.09Å | 1.10Å | |
| C21 | 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 | |
| C27 | H17 | sing | 1.09Å | 1.10Å | |
| C27 | H18 | sing | 1.09Å | 1.10Å | |
| C26 | H19 | sing | 1.09Å | 1.10Å | |
| C26 | H20 | sing | 1.09Å | 1.10Å | |
| C18 | H21 | sing | 1.09Å | 1.10Å | |
| N17 | H22 | sing | 0.97Å | 1.00Å | |
| C23 | H23 | sing | 1.09Å | 1.10Å | |
| C23 | H24 | sing | 1.09Å | 1.10Å | |
| C25 | H25 | sing | 1.09Å | 1.10Å | |
| C25 | H26 | sing | 1.09Å | 1.10Å | |
| C28 | H27 | sing | 1.09Å | 1.10Å | |
| C28 | H28 | sing | 1.09Å | 1.10Å | |
| C29 | H29 | sing | 1.09Å | 1.10Å | |
| C29 | H30 | sing | 1.09Å | 1.10Å | |
| N13 | H31 | sing | 0.97Å | 1.00Å | |
| N10 | H32 | sing | 0.97Å | 1.00Å | |
| C6 | H33 | sing | 1.09Å | 1.10Å | |
| O8 | H34 | sing | 0.97Å | 0.95Å | |
| C5 | H35 | sing | 1.09Å | 1.10Å | |
| C5 | H36 | sing | 1.09Å | 1.10Å | |
| C4 | H37 | sing | 1.09Å | 1.10Å | |
| C4 | H38 | sing | 1.09Å | 1.10Å | |
| N1 | H39 | sing | 1.01Å | 1.00Å | |
| N1 | H40 | sing | 1.01Å | 1.00Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C19 | C27 | C10 | 96.7° | 96.1° |
| C27 | C19 | C18 | 99.1° | 100.6° |
| C27 | C19 | C20 | 100.5° | 100.7° |
| C27 | C19 | H9 | 114.5° | 116.8° |
| C19 | C27 | H17 | 112.6° | 112.0° |
| C19 | C27 | H18 | 112.6° | 112.0° |
| C27 | C10 | C8 | 98.3° | 100.7° |
| C27 | C10 | C26 | 101.0° | 100.6° |
| C27 | C10 | H7 | 115.3° | 116.8° |
| C10 | C27 | H17 | 112.6° | 112.1° |
| C10 | C27 | H18 | 112.6° | 112.0° |
| C18 | C19 | C20 | 113.2° | 104.5° |
| C19 | C18 | C8 | 102.6° | 104.5° |
| C19 | C18 | N17 | 116.7° | 110.4° |
| C18 | C19 | H9 | 113.8° | 115.9° |
| C19 | C18 | H21 | 109.0° | 110.4° |
| C19 | C20 | C26 | 103.0° | 104.6° |
| C20 | C19 | H9 | 114.1° | 115.9° |
| C19 | C20 | H10 | 111.1° | 110.4° |
| C19 | C20 | H11 | 111.1° | 110.4° |
| O16 | C15 | N17 | 125.4° | 120.0° |
| O16 | C15 | C14 | 119.0° | 120.0° |
| C8 | C18 | N17 | 109.4° | 110.4° |
| C18 | C8 | C10 | 103.4° | 104.7° |
| C18 | C8 | H5 | 111.0° | 110.4° |
| C18 | C8 | H6 | 111.0° | 110.4° |
| C8 | C18 | H21 | 109.0° | 110.5° |
| C18 | N17 | C15 | 123.4° | 120.0° |
| N17 | C18 | H21 | 109.7° | 110.5° |
| C18 | N17 | H22 | 118.3° | 120.0° |
| C8 | C10 | C26 | 111.8° | 104.5° |
| C10 | C8 | H5 | 111.0° | 110.4° |
| C10 | C8 | H6 | 111.0° | 110.4° |
| C8 | C10 | H7 | 114.4° | 115.9° |
| C10 | C26 | C20 | 103.0° | 104.7° |
| C26 | C10 | H7 | 114.3° | 116.0° |
| C10 | C26 | H19 | 111.1° | 110.4° |
| C10 | C26 | H20 | 111.1° | 110.4° |
| C26 | C20 | H10 | 111.1° | 110.4° |
| C26 | C20 | H11 | 111.1° | 110.4° |
| C20 | C26 | H19 | 111.1° | 110.4° |
| C20 | C26 | H20 | 111.1° | 110.4° |
| N17 | C15 | C14 | 115.4° | 120.0° |
| C15 | N17 | H22 | 118.3° | 120.0° |
| C15 | C14 | C21 | 121.1° | 109.5° |
| C15 | C14 | N13 | 115.5° | 109.5° |
| C15 | C14 | H8 | 100.5° | 109.5° |
| C24 | C23 | C22 | 109.9° | 109.5° |
| C23 | C24 | C25 | 112.2° | 109.5° |
| C23 | C24 | H15 | 108.8° | 109.5° |
| C23 | C24 | H16 | 108.8° | 109.5° |
| C24 | C23 | H23 | 109.4° | 109.4° |
| C24 | C23 | H24 | 109.4° | 109.5° |
| C23 | C22 | C21 | 115.2° | 109.5° |
| C23 | C22 | C29 | 112.1° | 109.4° |
| C23 | C22 | H14 | 105.7° | 109.5° |
| C22 | C23 | H23 | 109.4° | 109.5° |
| C22 | C23 | H24 | 109.3° | 109.5° |
| C24 | C25 | C28 | 110.9° | 109.5° |
| C25 | C24 | H15 | 108.8° | 109.5° |
| C25 | C24 | H16 | 108.8° | 109.4° |
| C24 | C25 | H25 | 109.1° | 109.5° |
| C24 | C25 | H26 | 109.1° | 109.5° |
| C21 | C14 | N13 | 113.9° | 109.5° |
| C14 | C21 | C22 | 124.0° | 109.5° |
| C21 | C14 | H8 | 100.1° | 109.5° |
| C14 | C21 | H12 | 105.7° | 109.4° |
| C14 | C21 | H13 | 105.7° | 109.5° |
| C14 | N13 | C11 | 121.6° | 120.0° |
| N13 | C14 | H8 | 100.5° | 109.4° |
| C14 | N13 | H31 | 119.2° | 120.0° |
| O12 | C11 | N13 | 120.0° | 120.0° |
| O12 | C11 | N10 | 121.9° | 120.0° |
| C21 | C22 | C29 | 111.5° | 109.5° |
| C22 | C21 | H12 | 105.7° | 109.5° |
| C22 | C21 | H13 | 105.7° | 109.5° |
| C21 | C22 | H14 | 105.7° | 109.5° |
| C22 | C29 | C28 | 114.7° | 109.5° |
| C29 | C22 | H14 | 105.7° | 109.5° |
| C22 | C29 | H29 | 108.2° | 109.5° |
| C22 | C29 | H30 | 108.1° | 109.5° |
| O9 | C7 | O8 | 125.9° | 120.0° |
| O9 | C7 | C6 | 113.5° | 120.0° |
| O8 | C7 | C6 | 120.5° | 120.0° |
| C7 | O8 | H34 | 109.5° | 117.0° |
| C25 | C28 | C29 | 112.4° | 109.4° |
| C28 | C25 | H25 | 109.1° | 109.4° |
| C28 | C25 | H26 | 109.1° | 109.5° |
| C25 | C28 | H27 | 108.8° | 109.5° |
| C25 | C28 | H28 | 108.7° | 109.5° |
| N13 | C11 | N10 | 118.0° | 120.0° |
| C11 | N13 | H31 | 119.2° | 120.0° |
| C11 | N10 | C6 | 124.1° | 120.0° |
| C11 | N10 | H32 | 118.0° | 120.0° |
| C7 | C6 | N10 | 109.4° | 109.5° |
| C7 | C6 | C5 | 110.8° | 109.5° |
| C7 | C6 | H33 | 108.7° | 109.5° |
| C29 | C28 | H27 | 108.7° | 109.4° |
| C29 | C28 | H28 | 108.7° | 109.4° |
| C28 | C29 | H29 | 108.1° | 109.5° |
| C28 | C29 | H30 | 108.2° | 109.4° |
| N10 | C6 | C5 | 110.6° | 109.4° |
| C6 | N10 | H32 | 118.0° | 120.0° |
| N10 | C6 | H33 | 109.0° | 109.4° |
| C6 | C5 | C4 | 113.1° | 109.5° |
| C5 | C6 | H33 | 108.3° | 109.5° |
| C6 | C5 | H35 | 108.6° | 109.5° |
| C6 | C5 | H36 | 108.5° | 109.4° |
| C5 | C4 | C3 | 110.8° | 109.5° |
| C4 | C5 | H35 | 108.6° | 109.5° |
| C4 | C5 | H36 | 108.6° | 109.4° |
| C5 | C4 | H37 | 109.1° | 109.4° |
| C5 | C4 | H38 | 109.1° | 109.5° |
| C4 | C3 | C2 | 113.5° | 109.5° |
| C4 | C3 | H3 | 108.5° | 109.4° |
| C4 | C3 | H4 | 108.4° | 109.5° |
| C3 | C4 | H37 | 109.2° | 109.4° |
| C3 | C4 | H38 | 109.2° | 109.5° |
| N1 | C2 | C3 | 113.5° | 109.4° |
| N1 | C2 | H1 | 108.4° | 109.5° |
| N1 | C2 | H2 | 108.4° | 109.5° |
| C2 | N1 | H39 | 109.5° | 111.0° |
| C2 | N1 | H40 | 109.5° | 111.0° |
| C3 | C2 | H1 | 108.5° | 109.4° |
| C3 | C2 | H2 | 108.4° | 109.4° |
| C2 | C3 | H3 | 108.5° | 109.5° |
| C2 | C3 | H4 | 108.5° | 109.5° |
| H1 | C2 | H2 | 109.5° | 109.5° |
| H3 | C3 | H4 | 109.5° | 109.5° |
| H5 | C8 | H6 | 109.5° | 110.4° |
| H10 | C20 | H11 | 109.5° | 110.5° |
| H12 | C21 | H13 | 109.5° | 109.5° |
| H15 | C24 | H16 | 109.5° | 109.5° |
| H17 | C27 | H18 | 109.5° | 111.7° |
| H19 | C26 | H20 | 109.5° | 110.4° |
| H23 | C23 | H24 | 109.5° | 109.5° |
| H25 | C25 | H26 | 109.5° | 109.5° |
| H27 | C28 | H28 | 109.5° | 109.4° |
| H29 | C29 | H30 | 109.4° | 109.4° |
| H35 | C5 | H36 | 109.5° | 109.5° |
| H37 | C4 | H38 | 109.5° | 109.5° |
| H39 | N1 | H40 | 109.4° | 111.0° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C19 | C27 | C10 | H17 | 117.8° | 116.8° |
| C19 | C27 | C10 | H18 | 117.9° | 116.7° |
| C27 | C19 | C18 | C20 | 105.7° | 104.1° |
| C27 | C19 | C18 | H9 | 121.9° | 127.0° |
| C27 | C19 | C20 | H9 | 123.0° | 127.0° |
| C27 | C19 | C18 | C8 | 34.1° | 33.9° |
| C27 | C19 | C18 | N17 | 153.7° | 152.6° |
| C19 | C27 | C10 | C8 | 59.4° | 53.6° |
| C19 | C27 | C10 | C26 | 54.8° | 53.6° |
| C27 | C19 | C20 | C26 | 36.9° | 33.7° |
| C19 | C27 | C10 | H7 | 178.5° | 180.0° |
| C27 | C19 | C20 | H10 | 155.8° | 152.5° |
| C27 | C19 | C20 | H11 | 82.1° | 85.0° |
| C19 | C27 | H17 | H18 | 126.0° | 126.6° |
| C27 | C19 | C18 | H21 | 81.4° | 85.0° |
| C10 | C27 | C19 | C18 | 58.6° | 53.6° |
| C10 | C27 | C19 | C20 | 57.2° | 53.6° |
| C27 | C10 | C8 | C18 | 37.5° | 33.7° |
| C27 | C10 | C8 | C26 | 105.4° | 104.1° |
| C27 | C10 | C8 | H7 | 122.7° | 127.0° |
| C27 | C10 | C26 | H7 | 124.4° | 127.0° |
| C27 | C10 | C26 | C20 | 32.0° | 33.8° |
| C27 | C10 | C8 | H5 | 81.5° | 152.6° |
| C27 | C10 | C8 | H6 | 156.5° | 85.1° |
| C10 | C27 | C19 | H9 | 180.0° | 180.0° |
| C10 | C27 | H17 | H18 | 126.0° | 126.6° |
| C27 | C10 | C26 | H19 | 86.9° | 85.1° |
| C27 | C10 | C26 | H20 | 151.0° | 152.6° |
| C18 | C19 | C20 | H9 | 132.3° | 128.9° |
| C19 | C18 | C8 | N17 | 124.5° | 118.7° |
| C19 | C18 | C8 | H21 | 115.5° | 118.7° |
| C19 | C18 | N17 | H21 | 124.5° | 122.4° |
| C19 | C18 | C8 | C10 | 1.8° | 0.1° |
| C18 | C19 | C20 | C26 | 67.8° | 70.3° |
| C19 | C18 | N17 | C15 | 76.8° | 85.9° |
| C19 | C18 | C8 | H5 | 117.2° | 118.8° |
| C19 | C18 | C8 | H6 | 120.9° | 118.9° |
| C18 | C19 | C20 | H10 | 51.1° | 48.5° |
| C18 | C19 | C20 | H11 | 173.2° | 170.9° |
| C18 | C19 | C27 | H17 | 176.4° | 63.2° |
| C18 | C19 | C27 | H18 | 59.2° | 170.3° |
| C19 | C18 | N17 | H22 | 103.2° | 94.1° |
| C20 | C19 | C18 | C8 | 71.6° | 70.2° |
| C20 | C19 | C18 | N17 | 48.0° | 48.5° |
| C19 | C20 | C26 | C10 | 3.2° | 0.0° |
| C19 | C20 | C26 | H10 | 118.9° | 118.8° |
| C19 | C20 | C26 | H11 | 119.0° | 118.7° |
| C19 | C20 | H10 | H11 | 123.0° | 122.4° |
| C20 | C19 | C27 | H17 | 60.6° | 170.4° |
| C20 | C19 | C27 | H18 | 175.1° | 63.1° |
| C19 | C20 | C26 | H19 | 122.1° | 118.8° |
| C19 | C20 | C26 | H20 | 115.8° | 118.8° |
| C20 | C19 | C18 | H21 | 172.9° | 170.9° |
| O16 | C15 | N17 | C18 | 1.4° | 0.0° |
| O16 | C15 | N17 | C14 | 174.6° | 180.0° |
| O16 | C15 | C14 | C21 | 54.0° | 119.9° |
| O16 | C15 | C14 | N13 | 161.7° | 0.0° |
| O16 | C15 | C14 | H8 | 54.7° | 120.0° |
| O16 | C15 | N17 | H22 | 178.6° | 179.9° |
| C8 | C18 | N17 | H21 | 119.6° | 122.6° |
| C18 | C8 | C10 | H5 | 119.0° | 118.9° |
| C18 | C8 | C10 | H6 | 119.0° | 118.8° |
| C18 | C8 | C10 | C26 | 67.9° | 70.3° |
| C8 | C18 | N17 | C15 | 167.4° | 159.0° |
| C18 | C8 | H5 | H6 | 122.8° | 122.4° |
| C18 | C8 | C10 | H7 | 160.2° | 160.7° |
| C8 | C18 | C19 | H9 | 156.0° | 160.9° |
| C8 | C18 | N17 | H22 | 12.6° | 20.9° |
| N17 | C18 | C8 | C10 | 122.7° | 118.8° |
| C18 | N17 | C15 | H22 | 180.0° | 179.9° |
| C18 | N17 | C15 | C14 | 176.0° | 179.9° |
| N17 | C18 | C8 | H5 | 118.3° | 0.1° |
| N17 | C18 | C8 | H6 | 3.6° | 122.4° |
| N17 | C18 | C19 | H9 | 84.4° | 80.4° |
| C8 | C10 | C26 | H7 | 131.9° | 128.9° |
| C8 | C10 | C26 | C20 | 71.6° | 70.3° |
| C10 | C8 | H5 | H6 | 122.8° | 122.3° |
| C8 | C10 | C27 | H17 | 177.3° | 63.2° |
| C8 | C10 | C27 | H18 | 58.4° | 170.3° |
| C8 | C10 | C26 | H19 | 169.4° | 170.9° |
| C8 | C10 | C26 | H20 | 47.4° | 48.5° |
| C10 | C8 | C18 | H21 | 117.3° | 118.7° |
| C10 | C26 | C20 | H19 | 119.0° | 118.9° |
| C10 | C26 | C20 | H20 | 119.0° | 118.8° |
| C26 | C10 | C8 | H5 | 173.1° | 48.5° |
| C26 | C10 | C8 | H6 | 51.1° | 170.8° |
| C10 | C26 | C20 | H10 | 122.1° | 118.7° |
| C10 | C26 | C20 | H11 | 115.8° | 118.8° |
| C26 | C10 | C27 | H17 | 63.1° | 170.4° |
| C26 | C10 | C27 | H18 | 172.6° | 63.2° |
| C10 | C26 | H19 | H20 | 123.0° | 122.3° |
| C20 | C26 | C10 | H7 | 156.5° | 160.8° |
| C26 | C20 | C19 | H9 | 159.9° | 160.8° |
| C26 | C20 | H10 | H11 | 123.0° | 122.4° |
| C20 | C26 | H19 | H20 | 123.0° | 122.4° |
| N17 | C15 | C14 | C21 | 131.0° | 60.0° |
| N17 | C15 | C14 | N13 | 13.2° | 180.0° |
| N17 | C15 | C14 | H8 | 120.3° | 60.1° |
| C15 | N17 | C18 | H21 | 47.8° | 36.5° |
| C15 | C14 | C21 | N13 | 144.8° | 120.0° |
| C15 | C14 | C21 | H8 | 108.9° | 120.1° |
| C15 | C14 | N13 | H8 | 107.0° | 120.0° |
| C15 | C14 | C21 | C22 | 50.9° | 175.0° |
| C15 | C14 | N13 | C11 | 69.2° | 154.9° |
| C15 | C14 | C21 | H12 | 172.9° | 55.0° |
| C15 | C14 | C21 | H13 | 71.1° | 65.0° |
| C14 | C15 | N17 | H22 | 4.0° | 0.0° |
| C15 | C14 | N13 | H31 | 110.8° | 25.0° |
| C24 | C23 | C22 | H23 | 120.1° | 120.0° |
| C24 | C23 | C22 | H24 | 120.0° | 120.0° |
| C23 | C24 | C25 | H15 | 120.4° | 120.0° |
| C23 | C24 | C25 | H16 | 120.4° | 120.0° |
| C24 | C23 | C22 | C21 | 177.0° | NaN° |
| C24 | C23 | C22 | C29 | 54.0° | 60.0° |
| C23 | C24 | C25 | C28 | 57.8° | 60.0° |
| C24 | C23 | C22 | H14 | 60.7° | 60.0° |
| C23 | C24 | H15 | H16 | 118.7° | 120.0° |
| C24 | C23 | H23 | H24 | 119.8° | 120.0° |
| C23 | C24 | C25 | H25 | 178.1° | 180.0° |
| C23 | C24 | C25 | H26 | 62.4° | 60.0° |
| C22 | C23 | C24 | C25 | 59.6° | 60.0° |
| C23 | C22 | C21 | C14 | 32.5° | 65.0° |
| C23 | C22 | C21 | C29 | 129.3° | 120.0° |
| C23 | C22 | C21 | H14 | 116.3° | 120.0° |
| C23 | C22 | C29 | H14 | 114.7° | 120.0° |
| C23 | C22 | C29 | C28 | 48.5° | 60.0° |
| C23 | C22 | C21 | H12 | 154.4° | 54.9° |
| C23 | C22 | C21 | H13 | 89.5° | 175.0° |
| C22 | C23 | C24 | H15 | 60.8° | 60.0° |
| C22 | C23 | C24 | H16 | 180.0° | 180.0° |
| C22 | C23 | H23 | H24 | 119.8° | 120.0° |
| C23 | C22 | C29 | H29 | 72.3° | 60.0° |
| C23 | C22 | C29 | H30 | 169.3° | 180.0° |
| C24 | C25 | C28 | H25 | 120.2° | 120.0° |
| C24 | C25 | C28 | H26 | 120.2° | 120.0° |
| C24 | C25 | C28 | C29 | 49.8° | 60.0° |
| C25 | C24 | H15 | H16 | 118.7° | 120.0° |
| C25 | C24 | C23 | H23 | 60.4° | 180.0° |
| C25 | C24 | C23 | H24 | 179.7° | 60.0° |
| C24 | C25 | H25 | H26 | 119.3° | 120.0° |
| C24 | C25 | C28 | H27 | 70.6° | 60.0° |
| C24 | C25 | C28 | H28 | 170.3° | 180.0° |
| C21 | C14 | N13 | H8 | 106.1° | 120.0° |
| C14 | C21 | C22 | H12 | 122.0° | 119.9° |
| C14 | C21 | C22 | H13 | 122.0° | 120.0° |
| C14 | C21 | C22 | C29 | 96.8° | 175.0° |
| C21 | C14 | N13 | C11 | 144.0° | 85.0° |
| C14 | C21 | H12 | H13 | 113.5° | 120.0° |
| C14 | C21 | C22 | H14 | 148.8° | 55.0° |
| C21 | C14 | N13 | H31 | 36.0° | 95.0° |
| C14 | N13 | C11 | O12 | 8.1° | 0.1° |
| N13 | C14 | C21 | C22 | 93.9° | 65.0° |
| C14 | N13 | C11 | H31 | 180.0° | 180.0° |
| C14 | N13 | C11 | N10 | 175.3° | 180.0° |
| N13 | C14 | C21 | H12 | 28.1° | 175.0° |
| N13 | C14 | C21 | H13 | 144.1° | 55.0° |
| O12 | C11 | N13 | N10 | 176.6° | 179.9° |
| O12 | C11 | N10 | C6 | 0.8° | 0.0° |
| O12 | C11 | N13 | H31 | 171.9° | 180.0° |
| O12 | C11 | N10 | H32 | 179.2° | 179.9° |
| C21 | C22 | C29 | H14 | 114.4° | 120.0° |
| C21 | C22 | C29 | C28 | 179.4° | 180.0° |
| C22 | C21 | C14 | H8 | 159.8° | 54.9° |
| C22 | C21 | H12 | H13 | 113.5° | 120.0° |
| C21 | C22 | C23 | H23 | 62.9° | 60.0° |
| C21 | C22 | C23 | H24 | 57.0° | 60.0° |
| C21 | C22 | C29 | H29 | 58.6° | 60.0° |
| C21 | C22 | C29 | H30 | 59.8° | 60.0° |
| C22 | C29 | C28 | C25 | 46.4° | 60.0° |
| C22 | C29 | C28 | H29 | 120.8° | 120.0° |
| C22 | C29 | C28 | H30 | 120.8° | 120.0° |
| C29 | C22 | C21 | H12 | 25.1° | 65.0° |
| C29 | C22 | C21 | H13 | 141.2° | 55.0° |
| C29 | C22 | C23 | H23 | 66.1° | 180.0° |
| C29 | C22 | C23 | H24 | 174.0° | 60.0° |
| C22 | C29 | C28 | H27 | 74.1° | 60.0° |
| C22 | C29 | C28 | H28 | 166.8° | 180.0° |
| C22 | C29 | H29 | H30 | 117.6° | 120.0° |
| O9 | C7 | O8 | C6 | 178.9° | 179.9° |
| O9 | C7 | C6 | N10 | 29.5° | 0.1° |
| O9 | C7 | C6 | C5 | 92.7° | 120.0° |
| O9 | C7 | C6 | H33 | 148.4° | 119.9° |
| O9 | C7 | O8 | H34 | 0.0° | 0.1° |
| O8 | C7 | C6 | N10 | 149.5° | 180.0° |
| O8 | C7 | C6 | C5 | 88.3° | 60.1° |
| O8 | C7 | C6 | H33 | 30.5° | 60.0° |
| C25 | C28 | C29 | H27 | 120.5° | 120.0° |
| C25 | C28 | C29 | H28 | 120.4° | 120.0° |
| C28 | C25 | C24 | H15 | 62.6° | 60.0° |
| C28 | C25 | C24 | H16 | 178.2° | 180.0° |
| C28 | C25 | H25 | H26 | 119.3° | 120.0° |
| C25 | C28 | H27 | H28 | 118.7° | 120.1° |
| C25 | C28 | C29 | H29 | 74.4° | 60.0° |
| C25 | C28 | C29 | H30 | 167.1° | 180.0° |
| N13 | C11 | N10 | C6 | 177.3° | 180.0° |
| C11 | N13 | C14 | H8 | 37.9° | 35.0° |
| N13 | C11 | N10 | H32 | 2.7° | 0.0° |
| C11 | N10 | C6 | C7 | 48.7° | 85.0° |
| C11 | N10 | C6 | H32 | 180.0° | 180.0° |
| C11 | N10 | C6 | C5 | 171.0° | 155.0° |
| N10 | C11 | N13 | H31 | 4.7° | 0.1° |
| C11 | N10 | C6 | H33 | 70.1° | 35.0° |
| C7 | C6 | N10 | C5 | 122.3° | 120.0° |
| C7 | C6 | N10 | H33 | 118.7° | 120.0° |
| C7 | C6 | C5 | H33 | 119.1° | 120.1° |
| C7 | C6 | C5 | C4 | 63.9° | 175.0° |
| C7 | C6 | N10 | H32 | 131.3° | 95.0° |
| C6 | C7 | O8 | H34 | 178.8° | 180.0° |
| C7 | C6 | C5 | H35 | 175.6° | 65.0° |
| C7 | C6 | C5 | H36 | 56.7° | 55.1° |
| C28 | C29 | C22 | H14 | 66.2° | 60.0° |
| C29 | C28 | C25 | H25 | 170.0° | 180.0° |
| C29 | C28 | C25 | H26 | 70.4° | 60.0° |
| C29 | C28 | H27 | H28 | 118.7° | 119.9° |
| C28 | C29 | H29 | H30 | 117.6° | 119.9° |
| N10 | C6 | C5 | H33 | 119.4° | 120.0° |
| N10 | C6 | C5 | C4 | 174.6° | 65.0° |
| N10 | C6 | C5 | H35 | 54.1° | 55.0° |
| N10 | C6 | C5 | H36 | 64.9° | 175.0° |
| C6 | C5 | C4 | H35 | 120.5° | 120.1° |
| C6 | C5 | C4 | H36 | 120.5° | 119.9° |
| C6 | C5 | C4 | C3 | 142.5° | 180.0° |
| C5 | C6 | N10 | H32 | 9.0° | 25.0° |
| C6 | C5 | H35 | H36 | 118.3° | 120.0° |
| C6 | C5 | C4 | H37 | 97.3° | 60.1° |
| C6 | C5 | C4 | H38 | 22.2° | 59.9° |
| C5 | C4 | C3 | H37 | 120.2° | 119.9° |
| C5 | C4 | C3 | H38 | 120.2° | 120.1° |
| C5 | C4 | C3 | C2 | 162.9° | 180.0° |
| C5 | C4 | C3 | H3 | 76.5° | 60.1° |
| C5 | C4 | C3 | H4 | 42.3° | 59.9° |
| C4 | C5 | C6 | H33 | 55.2° | 54.9° |
| C4 | C5 | H35 | H36 | 118.4° | 120.0° |
| C5 | C4 | H37 | H38 | 119.4° | 120.0° |
| C4 | C3 | C2 | N1 | 45.9° | 180.0° |
| C4 | C3 | C2 | H3 | 120.6° | 119.9° |
| C4 | C3 | C2 | H4 | 120.6° | 120.0° |
| C4 | C3 | C2 | H1 | 74.7° | 60.0° |
| C4 | C3 | C2 | H2 | 166.5° | 60.0° |
| C4 | C3 | H3 | H4 | 118.1° | 120.0° |
| C3 | C4 | C5 | H35 | 21.9° | 60.0° |
| C3 | C4 | C5 | H36 | 97.0° | 60.1° |
| C3 | C4 | H37 | H38 | 119.4° | 120.0° |
| N1 | C2 | C3 | H1 | 120.6° | 120.0° |
| N1 | C2 | C3 | H2 | 120.6° | 120.0° |
| N1 | C2 | H1 | H2 | 118.1° | 120.1° |
| N1 | C2 | C3 | H3 | 74.7° | 60.0° |
| N1 | C2 | C3 | H4 | 166.4° | 60.0° |
| C2 | N1 | H39 | H40 | 120.0° | 123.9° |
| C3 | C2 | H1 | H2 | 118.1° | 119.9° |
| C2 | C3 | H3 | H4 | 118.2° | 120.0° |
| C2 | C3 | C4 | H37 | 42.7° | 60.0° |
| C2 | C3 | C4 | H38 | 76.9° | 60.0° |
| C3 | C2 | N1 | H39 | 180.0° | 180.0° |
| C3 | C2 | N1 | H40 | 60.0° | 56.1° |
| H1 | C2 | C3 | H3 | 164.6° | 60.0° |
| H1 | C2 | C3 | H4 | 45.8° | 180.0° |
| H1 | C2 | N1 | H39 | 59.4° | 60.1° |
| H1 | C2 | N1 | H40 | 60.6° | 176.0° |
| H2 | C2 | C3 | H3 | 45.8° | 180.0° |
| H2 | C2 | C3 | H4 | 73.0° | 60.0° |
| H2 | C2 | N1 | H39 | 59.4° | 60.0° |
| H2 | C2 | N1 | H40 | 179.4° | 63.9° |
| H3 | C3 | C4 | H37 | 163.3° | 180.0° |
| H3 | C3 | C4 | H38 | 43.7° | 60.0° |
| H4 | C3 | C4 | H37 | 77.9° | 60.0° |
| H4 | C3 | C4 | H38 | 162.5° | 180.0° |
| H5 | C8 | C10 | H7 | 41.2° | 80.4° |
| H5 | C8 | C18 | H21 | 1.8° | 122.5° |
| H6 | C8 | C10 | H7 | 80.8° | 41.9° |
| H6 | C8 | C18 | H21 | 123.7° | 0.2° |
| H7 | C10 | C27 | H17 | 60.7° | 63.2° |
| H7 | C10 | C27 | H18 | 63.6° | 63.3° |
| H7 | C10 | C26 | H19 | 37.5° | 41.9° |
| H7 | C10 | C26 | H20 | 84.6° | 80.4° |
| H8 | C14 | C21 | H12 | 78.2° | 65.0° |
| H8 | C14 | C21 | H13 | 37.8° | 174.9° |
| H8 | C14 | N13 | H31 | 142.1° | 145.0° |
| H9 | C19 | C20 | H10 | 81.1° | 80.4° |
| H9 | C19 | C20 | H11 | 40.9° | 42.0° |
| H9 | C19 | C27 | H17 | 62.2° | 63.2° |
| H9 | C19 | C27 | H18 | 62.1° | 63.3° |
| H9 | C19 | C18 | H21 | 40.5° | 42.1° |
| H10 | C20 | C26 | H19 | 118.9° | 122.4° |
| H10 | C20 | C26 | H20 | 3.1° | 0.1° |
| H11 | C20 | C26 | H19 | 3.1° | 0.1° |
| H11 | C20 | C26 | H20 | 125.2° | 122.4° |
| H12 | C21 | C22 | H14 | 89.3° | 175.0° |
| H13 | C21 | C22 | H14 | 26.8° | 65.0° |
| H14 | C22 | C23 | H23 | 179.2° | 60.0° |
| H14 | C22 | C23 | H24 | 59.4° | NaN° |
| H14 | C22 | C29 | H29 | 173.1° | NaN° |
| H14 | C22 | C29 | H30 | 54.6° | 60.0° |
| H15 | C24 | C23 | H23 | 179.1° | 60.0° |
| H15 | C24 | C23 | H24 | 59.2° | 180.0° |
| H15 | C24 | C25 | H25 | 57.7° | 60.0° |
| H15 | C24 | C25 | H26 | 177.2° | 180.0° |
| H16 | C24 | C23 | H23 | 60.0° | 60.0° |
| H16 | C24 | C23 | H24 | 59.9° | 60.0° |
| H16 | C24 | C25 | H25 | 61.5° | 60.0° |
| H16 | C24 | C25 | H26 | 58.0° | 60.0° |
| H21 | C18 | N17 | H22 | 132.2° | 143.5° |
| H25 | C25 | C28 | H27 | 49.6° | 60.0° |
| H25 | C25 | C28 | H28 | 69.5° | 60.0° |
| H26 | C25 | C28 | H27 | 169.2° | 180.0° |
| H26 | C25 | C28 | H28 | 50.0° | 60.0° |
| H27 | C28 | C29 | H29 | 165.1° | 180.0° |
| H27 | C28 | C29 | H30 | 46.7° | 60.0° |
| H28 | C28 | C29 | H29 | 46.0° | 60.0° |
| H28 | C28 | C29 | H30 | 72.4° | 59.9° |
| H32 | N10 | C6 | H33 | 109.9° | 145.0° |
| H33 | C6 | C5 | H35 | 65.3° | 175.0° |
| H33 | C6 | C5 | H36 | 175.8° | 65.0° |
| H35 | C5 | C4 | H37 | 142.1° | 60.0° |
| H35 | C5 | C4 | H38 | 98.3° | 180.0° |
| H36 | C5 | C4 | H37 | 23.2° | 180.0° |
| H36 | C5 | C4 | H38 | 142.8° | 60.0° |
