A1IJX
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| O19 | C11 | doub | 1.21Å | 1.20Å | |
| C23 | C03 | sing | 1.53Å | 1.50Å | |
| N04 | C03 | sing | 1.47Å | 1.51Å | |
| N04 | C05 | sing | 1.47Å | 1.49Å | |
| C07 | C06 | sing | 1.54Å | 1.61Å | |
| C07 | C08 | sing | 1.55Å | 1.61Å | |
| C06 | N10 | sing | 1.47Å | 1.36Å | |
| C06 | C05 | sing | 1.53Å | 1.55Å | |
| N13 | C12 | sing | 1.47Å | 1.44Å | |
| C11 | N10 | sing | 1.35Å | 1.46Å | |
| C11 | C12 | sing | 1.51Å | 1.54Å | |
| O21 | C20 | doub | 1.21Å | 1.28Å | |
| C03 | C02 | sing | 1.51Å | 1.55Å | |
| N10 | C09 | sing | 1.47Å | 1.63Å | |
| C05 | C20 | sing | 1.51Å | 1.51Å | |
| C12 | C14 | sing | 1.53Å | 1.55Å | |
| C20 | O22 | sing | 1.34Å | 1.29Å | |
| C08 | C09 | sing | 1.55Å | 1.44Å | |
| O18 | C16 | doub | 1.21Å | 1.29Å | |
| C02 | O01 | doub | 1.21Å | 1.21Å | |
| C02 | N24 | sing | 1.35Å | 1.47Å | |
| C14 | C15 | sing | 1.53Å | 1.54Å | |
| O31 | C29 | doub | 1.21Å | 1.25Å | |
| N24 | C25 | sing | 1.47Å | 1.64Å | |
| N24 | C28 | sing | 1.47Å | 1.38Å | |
| C25 | C26 | sing | 1.55Å | 1.41Å | |
| C16 | C15 | sing | 1.51Å | 1.55Å | |
| C16 | O17 | sing | 1.34Å | 1.28Å | |
| C29 | C28 | sing | 1.51Å | 1.53Å | |
| C29 | O30 | sing | 1.34Å | 1.30Å | |
| C28 | C27 | sing | 1.54Å | 1.57Å | |
| C26 | C27 | sing | 1.55Å | 1.61Å | |
| C03 | H1 | sing | 1.09Å | 1.10Å | |
| N04 | H2 | sing | 1.01Å | 1.00Å | |
| C05 | H4 | sing | 1.09Å | 1.10Å | |
| C06 | 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 | |
| C09 | H10 | sing | 1.09Å | 1.10Å | |
| C09 | H11 | sing | 1.09Å | 1.10Å | |
| C12 | H12 | sing | 1.09Å | 1.10Å | |
| N13 | H13 | sing | 1.01Å | 1.00Å | |
| N13 | H14 | sing | 1.01Å | 1.00Å | |
| C14 | H16 | sing | 1.09Å | 1.10Å | |
| C14 | H17 | sing | 1.09Å | 1.10Å | |
| C15 | H18 | sing | 1.09Å | 1.10Å | |
| C15 | H19 | sing | 1.09Å | 1.10Å | |
| O17 | H20 | sing | 0.97Å | 0.95Å | |
| O22 | H21 | sing | 0.97Å | 0.95Å | |
| C23 | H22 | sing | 1.09Å | 1.10Å | |
| 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 | |
| C26 | H27 | sing | 1.09Å | 1.10Å | |
| C26 | H28 | sing | 1.09Å | 1.10Å | |
| C27 | H29 | sing | 1.09Å | 1.10Å | |
| C27 | H30 | sing | 1.09Å | 1.10Å | |
| C28 | H31 | sing | 1.09Å | 1.10Å | |
| O30 | H32 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| O19 | C11 | N10 | 118.3° | 120.0° |
| O19 | C11 | C12 | 120.4° | 120.0° |
| C23 | C03 | N04 | 104.1° | 109.5° |
| C23 | C03 | C02 | 108.9° | 109.5° |
| C23 | C03 | H1 | 110.6° | 109.5° |
| C03 | C23 | H22 | 109.5° | 109.5° |
| C03 | C23 | H23 | 109.5° | 109.5° |
| C03 | C23 | H24 | 109.4° | 109.4° |
| C03 | N04 | C05 | 115.0° | 111.0° |
| N04 | C03 | C02 | 112.5° | 109.5° |
| N04 | C03 | H1 | 110.5° | 109.5° |
| C03 | N04 | H2 | 108.0° | 111.0° |
| N04 | C05 | C06 | 113.4° | 109.4° |
| N04 | C05 | C20 | 112.1° | 109.5° |
| C05 | N04 | H2 | 108.1° | 111.1° |
| N04 | C05 | H4 | 108.4° | 109.5° |
| C06 | C07 | C08 | 100.3° | 102.9° |
| C07 | C06 | N10 | 99.9° | 107.3° |
| C07 | C06 | C05 | 109.4° | 109.9° |
| C07 | C06 | H5 | 109.5° | 110.0° |
| C06 | C07 | H6 | 111.7° | 110.7° |
| C06 | C07 | H7 | 111.7° | 110.7° |
| C07 | C08 | C09 | 107.7° | 101.6° |
| C08 | C07 | H6 | 111.7° | 110.7° |
| C08 | C07 | H7 | 111.7° | 110.7° |
| C07 | C08 | H8 | 109.9° | 111.0° |
| C07 | C08 | H9 | 109.9° | 111.0° |
| N10 | C06 | C05 | 114.1° | 109.9° |
| C06 | N10 | C11 | 124.0° | 125.7° |
| C06 | N10 | C09 | 112.4° | 108.7° |
| N10 | C06 | H5 | 113.2° | 109.8° |
| C06 | C05 | C20 | 107.0° | 109.4° |
| C06 | C05 | H4 | 107.6° | 109.5° |
| C05 | C06 | H5 | 110.2° | 109.9° |
| N13 | C12 | C11 | 105.9° | 109.5° |
| N13 | C12 | C14 | 112.7° | 109.5° |
| N13 | C12 | H12 | 112.3° | 109.5° |
| C12 | N13 | H13 | 109.5° | 111.0° |
| C12 | N13 | H14 | 109.5° | 111.0° |
| N10 | C11 | C12 | 121.2° | 120.0° |
| C11 | N10 | C09 | 123.4° | 125.6° |
| C11 | C12 | C14 | 104.1° | 109.5° |
| C11 | C12 | H12 | 110.8° | 109.5° |
| O21 | C20 | C05 | 119.7° | 120.0° |
| O21 | C20 | O22 | 125.9° | 120.0° |
| C03 | C02 | O01 | 122.0° | 120.0° |
| C03 | C02 | N24 | 121.2° | 120.0° |
| C02 | C03 | H1 | 110.0° | 109.4° |
| N10 | C09 | C08 | 101.2° | 104.8° |
| N10 | C09 | H10 | 111.5° | 110.4° |
| N10 | C09 | H11 | 111.5° | 110.5° |
| C05 | C20 | O22 | 114.3° | 120.0° |
| C20 | C05 | H4 | 108.1° | 109.5° |
| C12 | C14 | C15 | 117.4° | 109.5° |
| C14 | C12 | H12 | 110.7° | 109.5° |
| C12 | C14 | H16 | 107.5° | 109.5° |
| C12 | C14 | H17 | 107.4° | 109.5° |
| C20 | O22 | H21 | 109.5° | 117.0° |
| C09 | C08 | H8 | 109.9° | 111.0° |
| C09 | C08 | H9 | 109.9° | 111.0° |
| C08 | C09 | H10 | 111.5° | 110.3° |
| C08 | C09 | H11 | 111.5° | 110.3° |
| O18 | C16 | C15 | 120.0° | 120.0° |
| O18 | C16 | O17 | 121.4° | 120.0° |
| O01 | C02 | N24 | 116.8° | 120.0° |
| C02 | N24 | C25 | 127.5° | 125.6° |
| C02 | N24 | C28 | 125.1° | 125.7° |
| C14 | C15 | C16 | 110.6° | 109.5° |
| C15 | C14 | H16 | 107.4° | 109.5° |
| C15 | C14 | H17 | 107.5° | 109.5° |
| C14 | C15 | H18 | 109.2° | 109.4° |
| C14 | C15 | H19 | 109.2° | 109.5° |
| O31 | C29 | C28 | 118.4° | 119.9° |
| O31 | C29 | O30 | 120.6° | 120.1° |
| C25 | N24 | C28 | 107.1° | 108.7° |
| N24 | C25 | C26 | 105.9° | 104.8° |
| N24 | C25 | H25 | 110.4° | 110.4° |
| N24 | C25 | H26 | 110.3° | 110.4° |
| N24 | C28 | C29 | 107.7° | 109.9° |
| N24 | C28 | C27 | 109.0° | 107.3° |
| N24 | C28 | H31 | 114.1° | 109.9° |
| C25 | C26 | C27 | 104.2° | 101.6° |
| C26 | C25 | H25 | 110.4° | 110.4° |
| C26 | C25 | H26 | 110.4° | 110.4° |
| C25 | C26 | H27 | 110.8° | 111.1° |
| C25 | C26 | H28 | 110.8° | 110.9° |
| C15 | C16 | O17 | 118.6° | 120.0° |
| C16 | C15 | H18 | 109.2° | 109.5° |
| C16 | C15 | H19 | 109.2° | 109.5° |
| C16 | O17 | H20 | 109.5° | 117.0° |
| C28 | C29 | O30 | 120.9° | 120.0° |
| C29 | C28 | C27 | 102.7° | 110.0° |
| C29 | C28 | H31 | 111.6° | 110.0° |
| C29 | O30 | H32 | 109.5° | 117.0° |
| C28 | C27 | C26 | 101.5° | 103.0° |
| C28 | C27 | H29 | 111.4° | 110.9° |
| C28 | C27 | H30 | 111.4° | 110.6° |
| C27 | C28 | H31 | 111.1° | 109.7° |
| C27 | C26 | H27 | 110.8° | 111.0° |
| C27 | C26 | H28 | 110.8° | 111.0° |
| C26 | C27 | H29 | 111.4° | 110.7° |
| C26 | C27 | H30 | 111.4° | 110.7° |
| H6 | C07 | H7 | 109.5° | 110.9° |
| H8 | C08 | H9 | 109.4° | 110.9° |
| H10 | C09 | H11 | 109.5° | 110.3° |
| H13 | N13 | H14 | 109.5° | 111.1° |
| H16 | C14 | H17 | 109.5° | 109.4° |
| H18 | C15 | H19 | 109.5° | 109.4° |
| H22 | C23 | H23 | 109.5° | 109.5° |
| H22 | C23 | H24 | 109.5° | 109.5° |
| H23 | C23 | H24 | 109.5° | 109.5° |
| H25 | C25 | H26 | 109.5° | 110.4° |
| H27 | C26 | H28 | 109.5° | 110.9° |
| H29 | C27 | H30 | 109.5° | 110.7° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| O19 | C11 | N10 | C06 | 4.0° | 4.5° |
| O19 | C11 | C12 | N13 | 46.7° | 19.9° |
| O19 | C11 | N10 | C12 | 176.5° | 179.9° |
| O19 | C11 | N10 | C09 | 178.0° | 175.5° |
| O19 | C11 | C12 | C14 | 72.3° | 100.0° |
| O19 | C11 | C12 | H12 | 168.8° | 139.9° |
| C23 | C03 | N04 | C02 | 117.8° | 120.0° |
| C23 | C03 | N04 | H1 | 118.8° | 120.1° |
| C23 | C03 | N04 | C05 | 168.0° | 85.0° |
| C23 | C03 | C02 | H1 | 121.4° | 120.0° |
| C23 | C03 | C02 | O01 | 93.7° | 119.9° |
| C23 | C03 | C02 | N24 | 87.0° | 59.7° |
| C23 | C03 | N04 | H2 | 71.2° | 151.0° |
| C03 | C23 | H22 | H23 | 120.0° | 120.0° |
| C03 | C23 | H22 | H24 | 120.0° | 119.9° |
| C03 | C23 | H23 | H24 | 120.0° | 120.0° |
| C03 | N04 | C05 | H2 | 120.8° | 124.0° |
| C03 | N04 | C05 | C06 | 170.4° | 155.1° |
| N04 | C03 | C02 | H1 | 123.7° | 119.9° |
| C03 | N04 | C05 | C20 | 49.1° | 85.0° |
| N04 | C03 | C02 | O01 | 21.2° | 0.1° |
| N04 | C03 | C02 | N24 | 158.1° | 179.7° |
| C03 | N04 | C05 | H4 | 70.2° | 35.1° |
| N04 | C03 | C23 | H22 | 180.0° | 60.0° |
| N04 | C03 | C23 | H23 | 60.0° | 180.0° |
| N04 | C03 | C23 | H24 | 60.0° | 60.0° |
| N04 | C05 | C06 | C07 | 76.6° | 56.0° |
| N04 | C05 | C06 | N10 | 172.5° | 61.8° |
| N04 | C05 | C06 | C20 | 124.1° | 120.0° |
| N04 | C05 | C06 | H4 | 119.9° | 120.0° |
| N04 | C05 | C20 | O21 | 65.6° | 27.5° |
| C05 | N04 | C03 | C02 | 74.2° | 155.0° |
| N04 | C05 | C20 | H4 | 119.4° | 120.0° |
| N04 | C05 | C20 | O22 | 112.9° | 152.5° |
| C05 | N04 | C03 | H1 | 49.2° | 35.1° |
| N04 | C05 | C06 | H5 | 43.8° | 177.2° |
| C06 | C07 | C08 | H6 | 118.5° | 118.3° |
| C06 | C07 | C08 | H7 | 118.5° | 118.3° |
| C07 | C06 | N10 | C05 | 116.5° | 119.4° |
| C07 | C06 | N10 | H5 | 116.4° | 119.6° |
| C07 | C06 | C05 | H5 | 120.4° | 121.2° |
| C07 | C06 | N10 | C11 | 137.6° | 178.9° |
| C07 | C06 | N10 | C09 | 36.9° | 1.1° |
| C07 | C06 | C05 | C20 | 159.3° | 64.0° |
| C06 | C07 | C08 | C09 | 33.7° | 35.5° |
| C07 | C06 | C05 | H4 | 43.3° | 176.0° |
| C06 | C07 | H6 | H7 | 124.3° | 123.3° |
| C06 | C07 | C08 | H8 | 86.0° | 153.6° |
| C06 | C07 | C08 | H9 | 153.5° | 82.6° |
| C08 | C07 | C06 | N10 | 41.8° | 22.2° |
| C08 | C07 | C06 | C05 | 78.3° | 141.6° |
| C07 | C08 | C09 | N10 | 13.1° | 37.0° |
| C07 | C08 | C09 | H8 | 119.7° | 118.1° |
| C07 | C08 | C09 | H9 | 119.8° | 118.1° |
| C08 | C07 | C06 | H5 | 160.9° | 97.3° |
| C08 | C07 | H6 | H7 | 124.3° | 123.2° |
| C07 | C08 | H8 | H9 | 120.8° | 123.9° |
| C07 | C08 | C09 | H10 | 105.6° | 81.8° |
| C07 | C08 | C09 | H11 | 131.7° | 156.0° |
| N10 | C06 | C05 | H5 | 128.7° | 121.0° |
| C06 | N10 | C11 | C09 | 174.0° | 180.0° |
| C06 | N10 | C11 | C12 | 179.5° | 175.4° |
| N10 | C06 | C05 | C20 | 48.4° | 178.2° |
| C06 | N10 | C09 | C08 | 16.5° | 24.1° |
| N10 | C06 | C05 | H4 | 67.6° | 58.2° |
| N10 | C06 | C07 | H6 | 160.3° | 96.1° |
| N10 | C06 | C07 | H7 | 76.7° | 140.5° |
| C06 | N10 | C09 | H10 | 135.1° | 94.7° |
| C06 | N10 | C09 | H11 | 102.2° | 143.0° |
| C05 | C06 | N10 | C11 | 105.8° | 61.6° |
| C06 | C05 | C20 | O21 | 59.4° | 92.5° |
| C05 | C06 | N10 | C09 | 79.6° | 118.4° |
| C06 | C05 | C20 | H4 | 115.7° | 120.0° |
| C06 | C05 | C20 | O22 | 122.2° | 87.6° |
| C06 | C05 | N04 | H2 | 68.8° | 31.0° |
| C05 | C06 | C07 | H6 | 40.2° | 23.3° |
| C05 | C06 | C07 | H7 | 163.2° | 100.1° |
| N13 | C12 | C11 | N10 | 136.9° | 160.0° |
| N13 | C12 | C11 | C14 | 119.0° | 120.0° |
| N13 | C12 | C11 | H12 | 122.0° | 120.0° |
| N13 | C12 | C14 | H12 | 126.7° | 120.0° |
| N13 | C12 | C14 | C15 | 91.0° | 65.0° |
| C12 | N13 | H13 | H14 | 120.0° | 124.0° |
| N13 | C12 | C14 | H16 | 30.2° | 55.0° |
| N13 | C12 | C14 | H17 | 147.9° | 175.0° |
| N10 | C11 | C12 | C14 | 104.2° | 80.0° |
| C11 | N10 | C09 | C08 | 158.1° | 155.9° |
| C11 | N10 | C06 | H5 | 21.3° | 59.4° |
| C11 | N10 | C09 | H10 | 39.5° | 85.3° |
| C11 | N10 | C09 | H11 | 83.2° | 37.0° |
| N10 | C11 | C12 | H12 | 14.8° | 40.0° |
| C12 | C11 | N10 | C09 | 5.5° | 4.6° |
| C11 | C12 | C14 | H12 | 119.0° | 120.0° |
| C11 | C12 | C14 | C15 | 154.8° | 175.0° |
| C11 | C12 | N13 | H13 | 180.0° | 59.9° |
| C11 | C12 | N13 | H14 | 60.0° | 176.1° |
| C11 | C12 | C14 | H16 | 84.1° | 65.0° |
| C11 | C12 | C14 | H17 | 33.6° | 55.0° |
| O21 | C20 | C05 | O22 | 178.4° | 180.0° |
| O21 | C20 | C05 | H4 | 175.0° | 147.5° |
| O21 | C20 | O22 | H21 | 0.0° | 4.7° |
| C03 | C02 | O01 | N24 | 179.3° | 179.6° |
| C03 | C02 | N24 | C25 | 3.3° | 0.3° |
| C03 | C02 | N24 | C28 | 175.4° | 179.4° |
| C02 | C03 | N04 | H2 | 46.6° | 31.0° |
| C02 | C03 | C23 | H22 | 59.8° | 60.0° |
| C02 | C03 | C23 | H23 | 179.8° | 60.0° |
| C02 | C03 | C23 | H24 | 60.2° | 180.0° |
| N10 | C09 | C08 | H10 | 118.7° | 118.8° |
| N10 | C09 | C08 | H11 | 118.6° | 119.0° |
| C09 | N10 | C06 | H5 | 153.3° | 120.6° |
| N10 | C09 | C08 | H8 | 106.7° | 155.0° |
| N10 | C09 | C08 | H9 | 132.8° | 81.1° |
| N10 | C09 | H10 | H11 | 123.8° | 122.4° |
| C20 | C05 | N04 | H2 | 169.9° | 151.0° |
| C20 | C05 | C06 | H5 | 80.3° | 57.2° |
| C05 | C20 | O22 | H21 | 178.3° | 175.4° |
| C12 | C14 | C15 | H16 | 121.1° | 120.0° |
| C12 | C14 | C15 | H17 | 121.1° | 120.0° |
| C12 | C14 | C15 | C16 | 80.8° | 180.0° |
| C14 | C12 | N13 | H13 | 66.8° | 60.1° |
| C14 | C12 | N13 | H14 | 173.2° | 64.0° |
| C12 | C14 | H16 | H17 | 116.4° | 120.0° |
| C12 | C14 | C15 | H18 | 159.1° | 60.0° |
| C12 | C14 | C15 | H19 | 39.4° | 60.0° |
| O22 | C20 | C05 | H4 | 6.5° | 32.4° |
| C09 | C08 | C07 | H6 | 152.3° | 82.9° |
| C09 | C08 | C07 | H7 | 84.7° | 153.8° |
| C09 | C08 | H8 | H9 | 120.8° | 123.9° |
| C08 | C09 | H10 | H11 | 123.9° | 122.2° |
| O18 | C16 | C15 | C14 | 5.5° | 0.0° |
| O18 | C16 | C15 | O17 | 178.5° | 180.0° |
| O18 | C16 | C15 | H18 | 125.7° | 120.0° |
| O18 | C16 | C15 | H19 | 114.7° | 120.0° |
| O18 | C16 | O17 | H20 | 0.0° | 0.1° |
| O01 | C02 | N24 | C25 | 177.3° | 179.9° |
| O01 | C02 | N24 | C28 | 5.3° | 0.2° |
| O01 | C02 | C03 | H1 | 144.9° | 120.0° |
| C02 | N24 | C25 | C28 | 173.2° | 179.8° |
| C02 | N24 | C25 | C26 | 171.0° | 155.8° |
| C02 | N24 | C28 | C29 | 55.0° | 61.7° |
| C02 | N24 | C28 | C27 | 165.7° | 178.8° |
| N24 | C02 | C03 | H1 | 34.4° | 60.4° |
| C02 | N24 | C25 | H25 | 51.5° | 37.0° |
| C02 | N24 | C25 | H26 | 69.6° | 85.3° |
| C02 | N24 | C28 | H31 | 69.4° | 59.5° |
| C14 | C15 | C16 | H18 | 120.2° | 120.0° |
| C14 | C15 | C16 | H19 | 120.2° | 120.0° |
| C14 | C15 | C16 | O17 | 176.0° | 180.0° |
| C15 | C14 | C12 | H12 | 35.8° | 55.0° |
| C15 | C14 | H16 | H17 | 116.4° | 120.0° |
| C14 | C15 | H18 | H19 | 119.5° | 120.0° |
| O31 | C29 | C28 | N24 | 30.7° | 0.0° |
| O31 | C29 | C28 | O30 | 175.4° | 180.0° |
| O31 | C29 | C28 | C27 | 84.3° | 117.9° |
| O31 | C29 | C28 | H31 | 156.6° | 121.1° |
| O31 | C29 | O30 | H32 | 0.0° | 0.1° |
| N24 | C25 | C26 | H25 | 119.5° | 118.8° |
| N24 | C25 | C26 | H26 | 119.4° | 118.8° |
| C25 | N24 | C28 | C29 | 118.4° | 118.1° |
| C25 | N24 | C28 | C27 | 7.6° | 1.4° |
| N24 | C25 | C26 | C27 | 30.9° | 37.0° |
| N24 | C25 | H25 | H26 | 121.6° | 122.3° |
| N24 | C25 | C26 | H27 | 88.2° | 81.1° |
| N24 | C25 | C26 | H28 | 150.1° | 155.1° |
| C25 | N24 | C28 | H31 | 117.2° | 120.7° |
| C28 | N24 | C25 | C26 | 15.8° | 24.4° |
| N24 | C28 | C29 | C27 | 115.0° | 117.9° |
| N24 | C28 | C29 | H31 | 126.0° | 121.1° |
| N24 | C28 | C29 | O30 | 144.7° | 180.0° |
| N24 | C28 | C27 | H31 | 126.6° | 119.4° |
| N24 | C28 | C27 | C26 | 25.4° | 21.9° |
| C28 | N24 | C25 | H25 | 135.3° | 143.2° |
| C28 | N24 | C25 | H26 | 103.6° | 94.5° |
| N24 | C28 | C27 | H29 | 93.3° | 140.3° |
| N24 | C28 | C27 | H30 | 144.1° | 96.5° |
| C25 | C26 | C27 | C28 | 35.0° | 35.3° |
| C25 | C26 | C27 | H27 | 119.2° | 118.2° |
| C25 | C26 | C27 | H28 | 119.2° | 118.0° |
| C26 | C25 | H25 | H26 | 121.7° | 122.4° |
| C25 | C26 | H27 | H28 | 122.4° | 123.9° |
| C25 | C26 | C27 | H29 | 83.7° | 153.9° |
| C25 | C26 | C27 | H30 | 153.7° | 83.0° |
| C16 | C15 | C14 | H16 | 40.4° | 60.0° |
| C16 | C15 | C14 | H17 | 158.1° | 60.0° |
| C16 | C15 | H18 | H19 | 119.5° | 120.0° |
| C15 | C16 | O17 | H20 | 178.5° | 179.9° |
| O17 | C16 | C15 | H18 | 55.8° | 60.0° |
| O17 | C16 | C15 | H19 | 63.8° | 60.0° |
| C29 | C28 | C27 | H31 | 119.4° | 121.1° |
| C29 | C28 | C27 | C26 | 139.4° | 141.4° |
| C29 | C28 | C27 | H29 | 20.7° | 100.2° |
| C29 | C28 | C27 | H30 | 101.8° | 23.0° |
| C28 | C29 | O30 | H32 | 175.3° | 180.0° |
| O30 | C29 | C28 | C27 | 100.2° | 62.1° |
| O30 | C29 | C28 | H31 | 18.8° | 58.9° |
| C28 | C27 | C26 | H29 | 118.7° | 118.6° |
| C28 | C27 | C26 | H30 | 118.7° | 118.3° |
| C28 | C27 | C26 | H27 | 84.2° | 82.8° |
| C28 | C27 | C26 | H28 | 154.2° | 153.3° |
| C28 | C27 | H29 | H30 | 123.7° | 123.2° |
| C27 | C26 | C25 | H25 | 150.4° | 155.9° |
| C27 | C26 | C25 | H26 | 88.5° | 81.8° |
| C27 | C26 | H27 | H28 | 122.4° | 123.9° |
| C26 | C27 | H29 | H30 | 123.7° | 123.2° |
| C26 | C27 | C28 | H31 | 101.2° | 97.5° |
| H1 | C03 | N04 | H2 | 170.0° | 88.9° |
| H1 | C03 | C23 | H22 | 61.2° | 180.0° |
| H1 | C03 | C23 | H23 | 58.8° | 60.0° |
| H1 | C03 | C23 | H24 | 178.8° | 60.0° |
| H2 | N04 | C05 | H4 | 50.6° | 89.0° |
| H4 | C05 | C06 | H5 | 163.7° | 62.8° |
| H5 | C06 | C07 | H6 | 80.6° | 144.4° |
| H5 | C06 | C07 | H7 | 42.4° | 21.1° |
| H6 | C07 | C08 | H8 | 32.5° | 35.2° |
| H6 | C07 | C08 | H9 | 88.0° | 159.1° |
| H7 | C07 | C08 | H8 | 155.5° | 88.1° |
| H7 | C07 | C08 | H9 | 35.0° | 35.7° |
| H8 | C08 | C09 | H10 | 134.7° | 36.2° |
| H8 | C08 | C09 | H11 | 12.0° | 86.0° |
| H9 | C08 | C09 | H10 | 14.2° | 160.1° |
| H9 | C08 | C09 | H11 | 108.5° | 37.9° |
| H12 | C12 | N13 | H13 | 59.0° | 179.9° |
| H12 | C12 | N13 | H14 | 61.0° | 56.1° |
| H12 | C12 | C14 | H16 | 156.9° | 175.0° |
| H12 | C12 | C14 | H17 | 85.4° | 65.0° |
| H16 | C14 | C15 | H18 | 79.8° | 180.0° |
| H16 | C14 | C15 | H19 | 160.6° | 60.0° |
| H17 | C14 | C15 | H18 | 37.9° | 60.1° |
| H17 | C14 | C15 | H19 | 81.7° | 180.0° |
| H22 | C23 | H23 | H24 | 120.0° | 120.0° |
| H25 | C25 | C26 | H27 | 31.2° | 37.7° |
| H25 | C25 | C26 | H28 | 90.5° | 86.1° |
| H26 | C25 | C26 | H27 | 152.3° | 160.1° |
| H26 | C25 | C26 | H28 | 30.7° | 36.2° |
| H27 | C26 | C27 | H29 | 157.1° | 35.7° |
| H27 | C26 | C27 | H30 | 34.6° | 158.9° |
| H28 | C26 | C27 | H29 | 35.4° | 88.1° |
| H28 | C26 | C27 | H30 | 87.1° | 35.0° |
| H29 | C27 | C28 | H31 | 140.1° | 21.0° |
| H30 | C27 | C28 | H31 | 17.5° | 144.1° |
