QZG
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C16 | C17 | sing | 1.54Å | 1.44Å | |
| C16 | N15 | sing | 1.47Å | 1.30Å | |
| C17 | C13 | sing | 1.55Å | 1.40Å | |
| O20 | C19 | sing | 1.43Å | 1.42Å | |
| O21 | C09 | doub | 1.21Å | 1.14Å | |
| C28 | C27 | sing | 1.53Å | 1.47Å | |
| N15 | C14 | sing | 1.34Å | 1.26Å | |
| C19 | C11 | sing | 1.53Å | 1.58Å | |
| C11 | C12 | sing | 1.53Å | 1.63Å | |
| C11 | N10 | sing | 1.46Å | 1.44Å | |
| C13 | C12 | sing | 1.53Å | 1.41Å | |
| C13 | C14 | sing | 1.51Å | 1.41Å | |
| C24 | C25 | sing | 1.53Å | 1.43Å | |
| C24 | C23 | sing | 1.53Å | 1.49Å | |
| C25 | C26 | sing | 1.53Å | 1.53Å | |
| C14 | O18 | doub | 1.21Å | 1.12Å | |
| C09 | N10 | sing | 1.35Å | 1.33Å | |
| C09 | C04 | sing | 1.51Å | 1.55Å | |
| C26 | C27 | sing | 1.53Å | 1.53Å | |
| C26 | C30 | sing | 1.53Å | 1.51Å | |
| C27 | C29 | sing | 1.53Å | 1.49Å | |
| O22 | C23 | sing | 1.45Å | 1.31Å | |
| O22 | C02 | sing | 1.35Å | 1.32Å | |
| N03 | C02 | sing | 1.35Å | 1.33Å | |
| N03 | C04 | sing | 1.47Å | 1.36Å | |
| C23 | C31 | sing | 1.53Å | 1.45Å | |
| C02 | O01 | doub | 1.22Å | 1.15Å | |
| C04 | C05 | sing | 1.53Å | 1.53Å | |
| C05 | C06 | sing | 1.53Å | 1.56Å | |
| C31 | C30 | sing | 1.53Å | 1.48Å | |
| C07 | C06 | sing | 1.53Å | 1.45Å | |
| C06 | C08 | sing | 1.53Å | 1.43Å | |
| C04 | H1 | sing | 1.09Å | 1.10Å | |
| C05 | H2 | sing | 1.09Å | 1.10Å | |
| C05 | H3 | sing | 1.09Å | 1.10Å | |
| C06 | H4 | sing | 1.09Å | 1.10Å | |
| C07 | H5 | sing | 1.09Å | 1.10Å | |
| C07 | H6 | sing | 1.09Å | 1.10Å | |
| C07 | H7 | sing | 1.09Å | 1.10Å | |
| C08 | H8 | sing | 1.09Å | 1.10Å | |
| C08 | H9 | sing | 1.09Å | 1.10Å | |
| C08 | H10 | sing | 1.09Å | 1.10Å | |
| C11 | H11 | sing | 1.09Å | 1.10Å | |
| C12 | H12 | sing | 1.09Å | 1.10Å | |
| C12 | H13 | sing | 1.09Å | 1.10Å | |
| C13 | H14 | sing | 1.09Å | 1.10Å | |
| C16 | H15 | sing | 1.09Å | 1.10Å | |
| C16 | H16 | sing | 1.09Å | 1.10Å | |
| C17 | H17 | sing | 1.09Å | 1.10Å | |
| C17 | H18 | sing | 1.09Å | 1.10Å | |
| C19 | H19 | sing | 1.09Å | 1.10Å | |
| C19 | H20 | sing | 1.09Å | 1.10Å | |
| C23 | H21 | sing | 1.09Å | 1.10Å | |
| C24 | H22 | sing | 1.09Å | 1.10Å | |
| C24 | H23 | sing | 1.09Å | 1.10Å | |
| C25 | H24 | sing | 1.09Å | 1.10Å | |
| C25 | H25 | sing | 1.09Å | 1.10Å | |
| C26 | H26 | sing | 1.09Å | 1.10Å | |
| C27 | H27 | sing | 1.09Å | 1.10Å | |
| C28 | H28 | sing | 1.09Å | 1.10Å | |
| C28 | H29 | sing | 1.09Å | 1.10Å | |
| C28 | H30 | sing | 1.09Å | 1.10Å | |
| C29 | H31 | sing | 1.09Å | 1.10Å | |
| C29 | H32 | sing | 1.09Å | 1.10Å | |
| C29 | H33 | sing | 1.09Å | 1.10Å | |
| C30 | H34 | sing | 1.09Å | 1.10Å | |
| C30 | H35 | sing | 1.09Å | 1.10Å | |
| C31 | H36 | sing | 1.09Å | 1.10Å | |
| C31 | H37 | sing | 1.09Å | 1.10Å | |
| N03 | H38 | sing | 0.97Å | 1.00Å | |
| N10 | H39 | sing | 0.97Å | 1.00Å | |
| N15 | H40 | sing | 0.97Å | 1.00Å | |
| O20 | H41 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C17 | C16 | N15 | 104.6° | 105.5° |
| C16 | C17 | C13 | 105.5° | 101.7° |
| C17 | C16 | H15 | 110.7° | 110.2° |
| C17 | C16 | H16 | 110.7° | 110.2° |
| C16 | C17 | H17 | 110.5° | 111.0° |
| C16 | C17 | H18 | 110.5° | 111.0° |
| C16 | N15 | C14 | 113.9° | 111.3° |
| N15 | C16 | H15 | 110.7° | 110.3° |
| N15 | C16 | H16 | 110.7° | 110.3° |
| C16 | N15 | H40 | 123.0° | 124.4° |
| C17 | C13 | C12 | 109.8° | 110.5° |
| C17 | C13 | C14 | 102.9° | 104.2° |
| C17 | C13 | H14 | 111.7° | 110.6° |
| C13 | C17 | H17 | 110.4° | 111.0° |
| C13 | C17 | H18 | 110.5° | 111.0° |
| O20 | C19 | C11 | 104.2° | 109.4° |
| O20 | C19 | H19 | 110.8° | 109.4° |
| O20 | C19 | H20 | 110.8° | 109.5° |
| C19 | O20 | H41 | 109.5° | 114.0° |
| O21 | C09 | N10 | 118.9° | 120.0° |
| O21 | C09 | C04 | 120.0° | 120.0° |
| C28 | C27 | C26 | 113.6° | 109.5° |
| C28 | C27 | C29 | 108.0° | 109.4° |
| C28 | C27 | H27 | 106.9° | 109.5° |
| C27 | C28 | H28 | 109.5° | 109.5° |
| C27 | C28 | H29 | 109.5° | 109.5° |
| C27 | C28 | H30 | 109.5° | 109.5° |
| N15 | C14 | C13 | 109.2° | 110.1° |
| N15 | C14 | O18 | 120.8° | 124.9° |
| C14 | N15 | H40 | 123.1° | 124.3° |
| C19 | C11 | C12 | 120.6° | 109.4° |
| C19 | C11 | N10 | 106.5° | 109.5° |
| C19 | C11 | H11 | 105.6° | 109.5° |
| C11 | C19 | H19 | 110.8° | 109.5° |
| C11 | C19 | H20 | 110.7° | 109.5° |
| C12 | C11 | N10 | 111.0° | 109.5° |
| C11 | C12 | C13 | 114.2° | 109.4° |
| C12 | C11 | H11 | 105.1° | 109.5° |
| C11 | C12 | H12 | 108.3° | 109.5° |
| C11 | C12 | H13 | 108.3° | 109.4° |
| C11 | N10 | C09 | 122.1° | 120.0° |
| N10 | C11 | H11 | 107.2° | 109.5° |
| C11 | N10 | H39 | 119.0° | 120.0° |
| C12 | C13 | C14 | 108.7° | 110.5° |
| C13 | C12 | H12 | 108.3° | 109.5° |
| C13 | C12 | H13 | 108.3° | 109.5° |
| C12 | C13 | H14 | 111.7° | 110.4° |
| C13 | C14 | O18 | 129.4° | 125.0° |
| C14 | C13 | H14 | 111.7° | 110.5° |
| C25 | C24 | C23 | 118.6° | 109.5° |
| C24 | C25 | C26 | 114.2° | 109.5° |
| C25 | C24 | H22 | 107.1° | 109.4° |
| C25 | C24 | H23 | 107.1° | 109.5° |
| C24 | C25 | H24 | 108.3° | 109.5° |
| C24 | C25 | H25 | 108.3° | 109.5° |
| C24 | C23 | O22 | 113.0° | 109.5° |
| C24 | C23 | C31 | 108.7° | 109.5° |
| C24 | C23 | H21 | 106.8° | 109.5° |
| C23 | C24 | H22 | 107.2° | 109.5° |
| C23 | C24 | H23 | 107.1° | 109.5° |
| C25 | C26 | C27 | 114.6° | 109.5° |
| C25 | C26 | C30 | 109.0° | 109.4° |
| C26 | C25 | H24 | 108.3° | 109.5° |
| C26 | C25 | H25 | 108.3° | 109.4° |
| C25 | C26 | H26 | 105.9° | 109.5° |
| N10 | C09 | C04 | 121.0° | 120.0° |
| C09 | N10 | H39 | 119.0° | 120.0° |
| C09 | C04 | N03 | 108.2° | 109.5° |
| C09 | C04 | C05 | 111.9° | 109.5° |
| C09 | C04 | H1 | 107.6° | 109.4° |
| C27 | C26 | C30 | 114.6° | 109.4° |
| C26 | C27 | C29 | 114.9° | 109.5° |
| C27 | C26 | H26 | 105.8° | 109.5° |
| C26 | C27 | H27 | 106.2° | 109.5° |
| C26 | C30 | C31 | 114.6° | 109.5° |
| C30 | C26 | H26 | 106.1° | 109.5° |
| C26 | C30 | H34 | 108.2° | 109.5° |
| C26 | C30 | H35 | 108.2° | 109.4° |
| C29 | C27 | H27 | 106.7° | 109.5° |
| C27 | C29 | H31 | 109.5° | 109.5° |
| C27 | C29 | H32 | 109.4° | 109.5° |
| C27 | C29 | H33 | 109.4° | 109.5° |
| C23 | O22 | C02 | 120.8° | 117.0° |
| O22 | C23 | C31 | 111.6° | 109.5° |
| O22 | C23 | H21 | 109.2° | 109.5° |
| O22 | C02 | N03 | 114.7° | 120.0° |
| O22 | C02 | O01 | 122.8° | 120.0° |
| C02 | N03 | C04 | 119.9° | 120.0° |
| N03 | C02 | O01 | 122.5° | 120.0° |
| C02 | N03 | H38 | 120.1° | 120.0° |
| N03 | C04 | C05 | 111.2° | 109.5° |
| N03 | C04 | H1 | 110.1° | 109.4° |
| C04 | N03 | H38 | 120.1° | 119.9° |
| C23 | C31 | C30 | 117.0° | 109.5° |
| C31 | C23 | H21 | 107.3° | 109.5° |
| C23 | C31 | H36 | 107.5° | 109.4° |
| C23 | C31 | H37 | 107.6° | 109.5° |
| C04 | C05 | C06 | 118.5° | 109.5° |
| C05 | C04 | H1 | 107.8° | 109.5° |
| C04 | C05 | H2 | 107.2° | 109.5° |
| C04 | C05 | H3 | 107.2° | 109.5° |
| C05 | C06 | C07 | 114.2° | 109.5° |
| C05 | C06 | C08 | 114.1° | 109.5° |
| C06 | C05 | H2 | 107.2° | 109.4° |
| C06 | C05 | H3 | 107.2° | 109.4° |
| C05 | C06 | H4 | 105.2° | 109.4° |
| C31 | C30 | H34 | 108.2° | 109.5° |
| C31 | C30 | H35 | 108.2° | 109.5° |
| C30 | C31 | H36 | 107.5° | 109.5° |
| C30 | C31 | H37 | 107.5° | 109.5° |
| C07 | C06 | C08 | 109.8° | 109.5° |
| C07 | C06 | H4 | 106.3° | 109.4° |
| C06 | C07 | H5 | 109.5° | 109.4° |
| C06 | C07 | H6 | 109.5° | 109.5° |
| C06 | C07 | H7 | 109.5° | 109.5° |
| C08 | C06 | H4 | 106.6° | 109.5° |
| C06 | C08 | H8 | 109.5° | 109.5° |
| C06 | C08 | H9 | 109.5° | 109.5° |
| C06 | C08 | H10 | 109.5° | 109.5° |
| H2 | C05 | H3 | 109.4° | 109.4° |
| H5 | C07 | H6 | 109.5° | 109.5° |
| H5 | C07 | H7 | 109.5° | 109.5° |
| H6 | C07 | H7 | 109.4° | 109.5° |
| H8 | C08 | H9 | 109.5° | 109.5° |
| H8 | C08 | H10 | 109.5° | 109.4° |
| H9 | C08 | H10 | 109.5° | 109.4° |
| H12 | C12 | H13 | 109.5° | 109.5° |
| H15 | C16 | H16 | 109.5° | 110.3° |
| H17 | C17 | H18 | 109.5° | 111.0° |
| H19 | C19 | H20 | 109.5° | 109.5° |
| H22 | C24 | H23 | 109.5° | 109.4° |
| H24 | C25 | H25 | 109.5° | 109.5° |
| H28 | C28 | H29 | 109.4° | 109.5° |
| H28 | C28 | H30 | 109.4° | 109.4° |
| H29 | C28 | H30 | 109.5° | 109.4° |
| H31 | C29 | H32 | 109.5° | 109.5° |
| H31 | C29 | H33 | 109.4° | 109.4° |
| H32 | C29 | H33 | 109.5° | 109.5° |
| H34 | C30 | H35 | 109.4° | 109.5° |
| H36 | C31 | H37 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C17 | C16 | N15 | H15 | 119.2° | 119.0° |
| C17 | C16 | N15 | H16 | 119.2° | 119.0° |
| C16 | C17 | C13 | H17 | 119.4° | 118.1° |
| C16 | C17 | C13 | H18 | 119.4° | 118.1° |
| C17 | C16 | N15 | C14 | 9.0° | 17.0° |
| C16 | C17 | C13 | C12 | 135.1° | 93.9° |
| C16 | C17 | C13 | C14 | 19.5° | 24.8° |
| C16 | C17 | C13 | H14 | 100.4° | 143.6° |
| C17 | C16 | H15 | H16 | 122.3° | 121.9° |
| C16 | C17 | H17 | H18 | 121.9° | 123.8° |
| C17 | C16 | N15 | H40 | 171.0° | 162.9° |
| N15 | C16 | C17 | C13 | 18.0° | 25.4° |
| C16 | N15 | C14 | H40 | 180.0° | 180.0° |
| C16 | N15 | C14 | C13 | 3.8° | 0.4° |
| C16 | N15 | C14 | O18 | 175.9° | 179.6° |
| N15 | C16 | H15 | H16 | 122.2° | 122.0° |
| N15 | C16 | C17 | H17 | 137.3° | 143.5° |
| N15 | C16 | C17 | H18 | 101.4° | 92.6° |
| C17 | C13 | C14 | N15 | 15.0° | 16.3° |
| C17 | C13 | C12 | C11 | 73.1° | 178.7° |
| C17 | C13 | C12 | C14 | 111.9° | 114.8° |
| C17 | C13 | C12 | H14 | 124.5° | 122.6° |
| C17 | C13 | C14 | H14 | 120.0° | 118.8° |
| C17 | C13 | C14 | O18 | 173.7° | 163.7° |
| C17 | C13 | C12 | H12 | 166.3° | 61.2° |
| C17 | C13 | C12 | H13 | 47.6° | 58.8° |
| C13 | C17 | C16 | H15 | 137.2° | 93.6° |
| C13 | C17 | C16 | H16 | 101.2° | 144.4° |
| C13 | C17 | H17 | H18 | 121.9° | 123.8° |
| O20 | C19 | C11 | H19 | 119.2° | 119.9° |
| O20 | C19 | C11 | H20 | 119.2° | 120.0° |
| O20 | C19 | C11 | C12 | 53.0° | 55.0° |
| O20 | C19 | C11 | N10 | 179.4° | 65.0° |
| O20 | C19 | C11 | H11 | 65.6° | 175.0° |
| O20 | C19 | H19 | H20 | 122.5° | 120.0° |
| O21 | C09 | N10 | C11 | 2.5° | 5.6° |
| O21 | C09 | N10 | C04 | 176.1° | 179.9° |
| O21 | C09 | C04 | N03 | 40.7° | 22.0° |
| O21 | C09 | C04 | C05 | 82.1° | 98.0° |
| O21 | C09 | C04 | H1 | 159.7° | 141.9° |
| O21 | C09 | N10 | H39 | 177.4° | 174.5° |
| C28 | C27 | C26 | C25 | 58.3° | 60.0° |
| C28 | C27 | C26 | C29 | 125.2° | 120.0° |
| C28 | C27 | C26 | H27 | 117.2° | 120.0° |
| C28 | C27 | C26 | C30 | 174.5° | 180.0° |
| C28 | C27 | C29 | H27 | 114.6° | 120.0° |
| C28 | C27 | C26 | H26 | 57.9° | 60.0° |
| C27 | C28 | H28 | H29 | 120.0° | 120.1° |
| C27 | C28 | H28 | H30 | 120.0° | 120.0° |
| C27 | C28 | H29 | H30 | 120.0° | 120.0° |
| C28 | C27 | C29 | H31 | 180.0° | 60.0° |
| C28 | C27 | C29 | H32 | 60.0° | 180.0° |
| C28 | C27 | C29 | H33 | 60.0° | 60.0° |
| N15 | C14 | C13 | C12 | 131.4° | 102.4° |
| N15 | C14 | C13 | O18 | 171.2° | 180.0° |
| N15 | C14 | C13 | H14 | 105.0° | 135.1° |
| C14 | N15 | C16 | H15 | 128.2° | 102.0° |
| C14 | N15 | C16 | H16 | 110.3° | 136.0° |
| C19 | C11 | C12 | N10 | 125.6° | 120.0° |
| C19 | C11 | C12 | H11 | 118.9° | 120.0° |
| C19 | C11 | N10 | H11 | 112.7° | 120.0° |
| C19 | C11 | C12 | C13 | 176.7° | 175.0° |
| C19 | C11 | N10 | C09 | 112.0° | 85.1° |
| C19 | C11 | C12 | H12 | 62.6° | 65.0° |
| C19 | C11 | C12 | H13 | 56.1° | 55.0° |
| C11 | C19 | H19 | H20 | 122.4° | 120.1° |
| C19 | C11 | N10 | H39 | 68.1° | 95.0° |
| C11 | C19 | O20 | H41 | 180.0° | 180.0° |
| C12 | C11 | N10 | H11 | 114.2° | 120.0° |
| C11 | C12 | C13 | H12 | 120.7° | 120.0° |
| C11 | C12 | C13 | H13 | 120.7° | 120.0° |
| C11 | C12 | C13 | C14 | 175.1° | 66.5° |
| C12 | C11 | N10 | C09 | 114.9° | 155.0° |
| C11 | C12 | H12 | H13 | 117.9° | 120.0° |
| C11 | C12 | C13 | H14 | 51.5° | 56.1° |
| C12 | C11 | C19 | H19 | 172.2° | 174.9° |
| C12 | C11 | C19 | H20 | 66.1° | 65.0° |
| C12 | C11 | N10 | H39 | 65.0° | 24.9° |
| N10 | C11 | C12 | C13 | 57.7° | 65.0° |
| C11 | N10 | C09 | H39 | 180.0° | 179.9° |
| C11 | N10 | C09 | C04 | 178.6° | 174.5° |
| N10 | C11 | C12 | H12 | 63.0° | 55.0° |
| N10 | C11 | C12 | H13 | 178.4° | 175.0° |
| N10 | C11 | C19 | H19 | 60.2° | 55.0° |
| N10 | C11 | C19 | H20 | 61.5° | 175.0° |
| C12 | C13 | C14 | H14 | 123.6° | 122.5° |
| C12 | C13 | C14 | O18 | 57.3° | 77.6° |
| C13 | C12 | C11 | H11 | 57.8° | 55.0° |
| C13 | C12 | H12 | H13 | 117.8° | 120.1° |
| C12 | C13 | C17 | H17 | 105.5° | 24.2° |
| C12 | C13 | C17 | H18 | 15.7° | 148.1° |
| C14 | C13 | C12 | H12 | 54.4° | 53.5° |
| C14 | C13 | C12 | H13 | 64.2° | 173.6° |
| C14 | C13 | C17 | H17 | 138.9° | 142.9° |
| C14 | C13 | C17 | H18 | 99.8° | 93.3° |
| C13 | C14 | N15 | H40 | 176.2° | 179.5° |
| C25 | C24 | C23 | H22 | 121.3° | 120.0° |
| C25 | C24 | C23 | H23 | 121.3° | 120.0° |
| C24 | C25 | C26 | H24 | 120.7° | 120.0° |
| C24 | C25 | C26 | H25 | 120.7° | 120.0° |
| C24 | C25 | C26 | C27 | 176.1° | 180.0° |
| C24 | C25 | C26 | C30 | 46.1° | 60.0° |
| C25 | C24 | C23 | O22 | 171.9° | 180.0° |
| C25 | C24 | C23 | C31 | 47.4° | 60.0° |
| C25 | C24 | C23 | H21 | 68.0° | 60.0° |
| C25 | C24 | H22 | H23 | 115.9° | 119.9° |
| C24 | C25 | H24 | H25 | 117.9° | 120.0° |
| C24 | C25 | C26 | H26 | 67.6° | 60.0° |
| C23 | C24 | C25 | C26 | 49.5° | 60.0° |
| C24 | C23 | O22 | C31 | 122.9° | 120.0° |
| C24 | C23 | O22 | H21 | 118.7° | 120.0° |
| C24 | C23 | O22 | C02 | 95.0° | 90.0° |
| C24 | C23 | C31 | H21 | 115.1° | 120.0° |
| C24 | C23 | C31 | C30 | 46.9° | 60.0° |
| C23 | C24 | H22 | H23 | 115.9° | 120.1° |
| C23 | C24 | C25 | H24 | 71.2° | 60.0° |
| C23 | C24 | C25 | H25 | 170.2° | 180.0° |
| C24 | C23 | C31 | H36 | 74.2° | 60.0° |
| C24 | C23 | C31 | H37 | 168.0° | 180.0° |
| C25 | C26 | C27 | C30 | 127.2° | 120.0° |
| C25 | C26 | C27 | H26 | 116.3° | 120.0° |
| C25 | C26 | C30 | H26 | 113.6° | 120.0° |
| C25 | C26 | C27 | C29 | 176.5° | 180.0° |
| C25 | C26 | C30 | C31 | 46.6° | 60.0° |
| C26 | C25 | C24 | H22 | 71.8° | 180.0° |
| C26 | C25 | C24 | H23 | 170.8° | 60.0° |
| C26 | C25 | H24 | H25 | 117.8° | 120.0° |
| C25 | C26 | C27 | H27 | 58.8° | 60.0° |
| C25 | C26 | C30 | H34 | 74.2° | 60.0° |
| C25 | C26 | C30 | H35 | 167.4° | 180.0° |
| O18 | C14 | C13 | H14 | 66.3° | 44.9° |
| O18 | C14 | N15 | H40 | 4.1° | 0.4° |
| N10 | C09 | C04 | N03 | 135.4° | 158.1° |
| N10 | C09 | C04 | C05 | 101.8° | 81.9° |
| N10 | C09 | C04 | H1 | 16.4° | 38.2° |
| C09 | N10 | C11 | H11 | 0.7° | 35.0° |
| C09 | C04 | N03 | C02 | 76.3° | 154.9° |
| C09 | C04 | N03 | C05 | 123.2° | 120.0° |
| C09 | C04 | N03 | H1 | 117.4° | 119.9° |
| C09 | C04 | C05 | H1 | 118.1° | 120.0° |
| C09 | C04 | C05 | C06 | 178.9° | 62.3° |
| C09 | C04 | C05 | H2 | 57.7° | 177.7° |
| C09 | C04 | C05 | H3 | 59.8° | 57.7° |
| C09 | C04 | N03 | H38 | 103.7° | 25.0° |
| C04 | C09 | N10 | H39 | 1.4° | 5.4° |
| C27 | C26 | C30 | H26 | 116.4° | 120.0° |
| C26 | C27 | C29 | H27 | 117.4° | 120.0° |
| C27 | C26 | C30 | C31 | 176.6° | 180.0° |
| C27 | C26 | C25 | H24 | 55.4° | 60.0° |
| C27 | C26 | C25 | H25 | 63.2° | 60.0° |
| C26 | C27 | C28 | H28 | 180.0° | 60.0° |
| C26 | C27 | C28 | H29 | 60.0° | 180.0° |
| C26 | C27 | C28 | H30 | 60.0° | 60.0° |
| C26 | C27 | C29 | H31 | 51.9° | 60.0° |
| C26 | C27 | C29 | H32 | 172.0° | 60.0° |
| C26 | C27 | C29 | H33 | 68.0° | 180.0° |
| C27 | C26 | C30 | H34 | 55.8° | 60.0° |
| C27 | C26 | C30 | H35 | 62.7° | 60.0° |
| C30 | C26 | C27 | C29 | 49.3° | 60.0° |
| C26 | C30 | C31 | C23 | 50.8° | 60.0° |
| C26 | C30 | C31 | H34 | 120.8° | 120.0° |
| C26 | C30 | C31 | H35 | 120.8° | 120.0° |
| C30 | C26 | C25 | H24 | 74.6° | 60.0° |
| C30 | C26 | C25 | H25 | 166.8° | 180.0° |
| C30 | C26 | C27 | H27 | 68.4° | 60.0° |
| C26 | C30 | H34 | H35 | 117.7° | 120.0° |
| C26 | C30 | C31 | H36 | 70.3° | 59.9° |
| C26 | C30 | C31 | H37 | 171.9° | 180.0° |
| C29 | C27 | C26 | H26 | 67.2° | 60.0° |
| C29 | C27 | C28 | H28 | 51.3° | 60.0° |
| C29 | C27 | C28 | H29 | 171.3° | 60.1° |
| C29 | C27 | C28 | H30 | 68.7° | 180.0° |
| C27 | C29 | H31 | H32 | 120.0° | 120.0° |
| C27 | C29 | H31 | H33 | 120.0° | 120.0° |
| C27 | C29 | H32 | H33 | 120.0° | 120.0° |
| C23 | O22 | C02 | N03 | 179.1° | 179.8° |
| O22 | C23 | C31 | H21 | 119.6° | 120.0° |
| C23 | O22 | C02 | O01 | 1.5° | 0.0° |
| O22 | C23 | C31 | C30 | 172.2° | 180.0° |
| O22 | C23 | C24 | H22 | 50.6° | 60.0° |
| O22 | C23 | C24 | H23 | 66.8° | 60.0° |
| O22 | C23 | C31 | H36 | 51.1° | 60.0° |
| O22 | C23 | C31 | H37 | 66.7° | 60.0° |
| O22 | C02 | N03 | O01 | 179.4° | 179.8° |
| O22 | C02 | N03 | C04 | 179.9° | 175.3° |
| C02 | O22 | C23 | C31 | 142.1° | 150.0° |
| C02 | O22 | C23 | H21 | 23.7° | 30.0° |
| O22 | C02 | N03 | H38 | 0.1° | 4.6° |
| C02 | N03 | C04 | H38 | 180.0° | 179.9° |
| C02 | N03 | C04 | C05 | 160.5° | 85.1° |
| C02 | N03 | C04 | H1 | 41.1° | 34.9° |
| C04 | N03 | C02 | O01 | 0.7° | 4.5° |
| N03 | C04 | C05 | H1 | 120.8° | 120.0° |
| N03 | C04 | C05 | C06 | 57.8° | 177.7° |
| N03 | C04 | C05 | H2 | 63.5° | 57.7° |
| N03 | C04 | C05 | H3 | 179.1° | 62.3° |
| C23 | C31 | C30 | H36 | 121.1° | 119.9° |
| C23 | C31 | C30 | H37 | 121.1° | 120.0° |
| C31 | C23 | C24 | H22 | 73.9° | 180.0° |
| C31 | C23 | C24 | H23 | 168.7° | 60.0° |
| C23 | C31 | C30 | H34 | 70.0° | 60.0° |
| C23 | C31 | C30 | H35 | 171.6° | 180.0° |
| C23 | C31 | H36 | H37 | 116.6° | 120.0° |
| O01 | C02 | N03 | H38 | 179.3° | 175.6° |
| C04 | C05 | C06 | H2 | 121.3° | 120.0° |
| C04 | C05 | C06 | H3 | 121.3° | 120.0° |
| C04 | C05 | C06 | C07 | 179.7° | 66.0° |
| C04 | C05 | C06 | C08 | 52.4° | 173.9° |
| C04 | C05 | H2 | H3 | 115.9° | 120.1° |
| C04 | C05 | C06 | H4 | 64.1° | 53.9° |
| C05 | C04 | N03 | H38 | 19.5° | 95.0° |
| C05 | C06 | C07 | C08 | 129.5° | 120.1° |
| C05 | C06 | C07 | H4 | 115.5° | 119.9° |
| C05 | C06 | C08 | H4 | 115.6° | 120.0° |
| C06 | C05 | C04 | H1 | 63.0° | 57.7° |
| C06 | C05 | H2 | H3 | 115.9° | 119.9° |
| C05 | C06 | C07 | H5 | 180.0° | 62.7° |
| C05 | C06 | C07 | H6 | 60.0° | 177.3° |
| C05 | C06 | C07 | H7 | 60.0° | 57.3° |
| C05 | C06 | C08 | H8 | 180.0° | 60.0° |
| C05 | C06 | C08 | H9 | 60.0° | 180.0° |
| C05 | C06 | C08 | H10 | 60.0° | 60.0° |
| C30 | C31 | C23 | H21 | 68.3° | 60.0° |
| C31 | C30 | C26 | H26 | 67.1° | 60.0° |
| C31 | C30 | H34 | H35 | 117.7° | 120.0° |
| C30 | C31 | H36 | H37 | 116.5° | 120.0° |
| C07 | C06 | C08 | H4 | 114.8° | 120.0° |
| C07 | C06 | C05 | H2 | 59.0° | 54.1° |
| C07 | C06 | C05 | H3 | 58.4° | 174.0° |
| C06 | C07 | H5 | H6 | 120.0° | 120.0° |
| C06 | C07 | H5 | H7 | 120.0° | 120.0° |
| C06 | C07 | H6 | H7 | 120.0° | 120.1° |
| C07 | C06 | C08 | H8 | 50.4° | 180.0° |
| C07 | C06 | C08 | H9 | 69.6° | 59.9° |
| C07 | C06 | C08 | H10 | 170.4° | 60.0° |
| C08 | C06 | C05 | H2 | 173.7° | 66.0° |
| C08 | C06 | C05 | H3 | 68.9° | 53.9° |
| C08 | C06 | C07 | H5 | 50.5° | 57.4° |
| C08 | C06 | C07 | H6 | 170.5° | 62.6° |
| C08 | C06 | C07 | H7 | 69.6° | 177.4° |
| C06 | C08 | H8 | H9 | 120.0° | 120.1° |
| C06 | C08 | H8 | H10 | 120.0° | 120.0° |
| C06 | C08 | H9 | H10 | 120.0° | 120.0° |
| H1 | C04 | C05 | H2 | 175.7° | 62.2° |
| H1 | C04 | C05 | H3 | 58.3° | 177.7° |
| H1 | C04 | N03 | H38 | 138.9° | 145.0° |
| H2 | C05 | C06 | H4 | 57.2° | 174.0° |
| H3 | C05 | C06 | H4 | 174.6° | 66.1° |
| H4 | C06 | C07 | H5 | 64.5° | 177.4° |
| H4 | C06 | C07 | H6 | 55.5° | 57.4° |
| H4 | C06 | C07 | H7 | 175.5° | 62.6° |
| H4 | C06 | C08 | H8 | 64.3° | 60.0° |
| H4 | C06 | C08 | H9 | 175.7° | 60.0° |
| H4 | C06 | C08 | H10 | 55.7° | 180.0° |
| H5 | C07 | H6 | H7 | 120.0° | 120.0° |
| H8 | C08 | H9 | H10 | 120.0° | 119.9° |
| H11 | C11 | C12 | H12 | 178.5° | 175.0° |
| H11 | C11 | C12 | H13 | 62.8° | 65.0° |
| H11 | C11 | C19 | H19 | 53.5° | 65.1° |
| H11 | C11 | C19 | H20 | 175.2° | 55.0° |
| H11 | C11 | N10 | H39 | 179.3° | 145.0° |
| H12 | C12 | C13 | H14 | 69.2° | 176.1° |
| H13 | C12 | C13 | H14 | 172.2° | 63.9° |
| H14 | C13 | C17 | H17 | 19.0° | 98.3° |
| H14 | C13 | C17 | H18 | 140.2° | 25.5° |
| H15 | C16 | C17 | H17 | 103.4° | 24.5° |
| H15 | C16 | C17 | H18 | 17.8° | 148.3° |
| H15 | C16 | N15 | H40 | 51.8° | 78.1° |
| H16 | C16 | C17 | H17 | 18.1° | 97.5° |
| H16 | C16 | C17 | H18 | 139.4° | 26.4° |
| H16 | C16 | N15 | H40 | 69.7° | 44.0° |
| H19 | C19 | O20 | H41 | 60.9° | 60.0° |
| H20 | C19 | O20 | H41 | 60.8° | 60.0° |
| H21 | C23 | C24 | H22 | 170.7° | 60.0° |
| H21 | C23 | C24 | H23 | 53.3° | 180.0° |
| H21 | C23 | C31 | H36 | 170.6° | 180.0° |
| H21 | C23 | C31 | H37 | 52.8° | 60.0° |
| H22 | C24 | C25 | H24 | 167.5° | 60.0° |
| H22 | C24 | C25 | H25 | 48.9° | 60.0° |
| H23 | C24 | C25 | H24 | 50.1° | 180.0° |
| H23 | C24 | C25 | H25 | 68.5° | 59.9° |
| H24 | C25 | C26 | H26 | 171.7° | 180.0° |
| H25 | C25 | C26 | H26 | 53.1° | 60.0° |
| H26 | C26 | C27 | H27 | 175.1° | 180.0° |
| H26 | C26 | C30 | H34 | 172.2° | 180.0° |
| H26 | C26 | C30 | H35 | 53.7° | 60.0° |
| H27 | C27 | C28 | H28 | 63.3° | 180.0° |
| H27 | C27 | C28 | H29 | 56.7° | 60.0° |
| H27 | C27 | C28 | H30 | 176.7° | 60.0° |
| H27 | C27 | C29 | H31 | 65.4° | 180.0° |
| H27 | C27 | C29 | H32 | 54.6° | 60.0° |
| H27 | C27 | C29 | H33 | 174.6° | 60.0° |
| H28 | C28 | H29 | H30 | 119.9° | 119.9° |
| H31 | C29 | H32 | H33 | 120.0° | 120.0° |
| H34 | C30 | C31 | H36 | 168.9° | 180.0° |
| H34 | C30 | C31 | H37 | 51.1° | 60.0° |
| H35 | C30 | C31 | H36 | 50.5° | 60.0° |
| H35 | C30 | C31 | H37 | 67.3° | 60.0° |
