GZX
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C24 | C23 | sing | 1.53Å | 1.54Å | |
| O22 | C21 | sing | 1.43Å | 1.40Å | |
| C29 | C27 | sing | 1.55Å | 1.56Å | |
| C23 | C21 | sing | 1.53Å | 1.54Å | |
| C23 | C25 | sing | 1.50Å | 1.56Å | |
| C21 | C19 | sing | 1.53Å | 1.55Å | |
| C25 | C27 | sing | 1.51Å | 1.59Å | |
| C25 | O26 | doub | 1.22Å | 1.20Å | |
| C27 | C28 | sing | 1.52Å | 1.56Å | |
| C27 | C30 | sing | 1.52Å | 1.56Å | |
| C18 | C19 | sing | 1.53Å | 1.54Å | |
| C18 | C17 | sing | 1.53Å | 1.56Å | |
| C19 | C20 | sing | 1.54Å | 1.53Å | |
| O31 | C30 | sing | 1.44Å | 1.39Å | |
| C30 | C32 | sing | 1.52Å | 1.55Å | |
| C17 | C16 | sing | 1.53Å | 1.55Å | |
| C16 | C14 | sing | 1.53Å | 1.55Å | |
| C32 | C33 | sing | 1.52Å | 1.56Å | |
| O13 | C14 | sing | 1.44Å | 1.46Å | |
| O13 | C12 | sing | 1.43Å | 1.45Å | |
| C01 | C02 | sing | 1.51Å | 1.56Å | |
| N35 | C33 | sing | 1.36Å | 1.49Å | |
| N35 | C10 | sing | 1.47Å | 1.45Å | |
| C11 | C12 | sing | 1.53Å | 1.55Å | |
| C11 | C10 | sing | 1.53Å | 1.53Å | |
| C14 | C12 | sing | 1.53Å | 1.44Å | |
| C14 | C15 | sing | 1.53Å | 1.55Å | |
| C33 | O34 | doub | 1.21Å | 1.20Å | |
| C10 | C02 | sing | 1.50Å | 1.53Å | |
| C02 | C03 | doub | 1.33Å | 1.35Å | |
| C05 | C04 | doub | 1.35Å | 1.41Å | Aromatic |
| C05 | S06 | sing | 1.76Å | 1.74Å | Aromatic |
| C03 | C04 | sing | 1.48Å | 1.56Å | |
| C04 | N09 | sing | 1.33Å | 1.33Å | Aromatic |
| S06 | C07 | sing | 1.71Å | 1.73Å | Aromatic |
| N09 | C07 | doub | 1.29Å | 1.33Å | Aromatic |
| C07 | C08 | sing | 1.51Å | 1.52Å | |
| C28 | H1 | sing | 1.09Å | 1.10Å | |
| C28 | H2 | sing | 1.09Å | 1.10Å | |
| C28 | H3 | sing | 1.09Å | 1.10Å | |
| C29 | H4 | sing | 1.09Å | 1.10Å | |
| C29 | H5 | sing | 1.09Å | 1.10Å | |
| C29 | H6 | sing | 1.09Å | 1.10Å | |
| C30 | H7 | sing | 1.10Å | 1.10Å | |
| C32 | H8 | sing | 1.10Å | 1.10Å | |
| C32 | H9 | sing | 1.08Å | 1.10Å | |
| C20 | H10 | sing | 1.09Å | 1.10Å | |
| C20 | H11 | sing | 1.09Å | 1.10Å | |
| C20 | H12 | sing | 1.09Å | 1.10Å | |
| C17 | H13 | sing | 1.09Å | 1.10Å | |
| C17 | H14 | sing | 1.09Å | 1.10Å | |
| C16 | H15 | sing | 1.09Å | 1.10Å | |
| C16 | H16 | sing | 1.09Å | 1.10Å | |
| C18 | H17 | sing | 1.09Å | 1.10Å | |
| C18 | H18 | sing | 1.09Å | 1.10Å | |
| C15 | H19 | sing | 1.09Å | 1.10Å | |
| C15 | H20 | sing | 1.09Å | 1.10Å | |
| C15 | H21 | sing | 1.09Å | 1.10Å | |
| C19 | H22 | sing | 1.09Å | 1.10Å | |
| C12 | H23 | sing | 1.09Å | 1.10Å | |
| C24 | H24 | sing | 1.09Å | 1.10Å | |
| C24 | H25 | sing | 1.09Å | 1.10Å | |
| C24 | H26 | sing | 1.09Å | 1.10Å | |
| C01 | H27 | sing | 1.09Å | 1.10Å | |
| C01 | H28 | sing | 1.09Å | 1.10Å | |
| C01 | H29 | sing | 1.09Å | 1.10Å | |
| C03 | H30 | sing | 1.08Å | 1.08Å | |
| C05 | H31 | sing | 1.08Å | 1.08Å | |
| C08 | H32 | sing | 1.09Å | 1.10Å | |
| C08 | H33 | sing | 1.09Å | 1.10Å | |
| C08 | H34 | sing | 1.09Å | 1.10Å | |
| C10 | H35 | sing | 1.10Å | 1.10Å | |
| C11 | H36 | sing | 1.09Å | 1.10Å | |
| C11 | H37 | sing | 1.09Å | 1.10Å | |
| C21 | H38 | sing | 1.10Å | 1.10Å | |
| C23 | H39 | sing | 1.10Å | 1.10Å | |
| N35 | H40 | sing | 0.98Å | 1.00Å | |
| O22 | H41 | sing | 0.97Å | 0.95Å | |
| O31 | H42 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C24 | C23 | C21 | 106.8° | 109.5° |
| C24 | C23 | C25 | 109.3° | 111.2° |
| C23 | C24 | H24 | 109.5° | 109.5° |
| C23 | C24 | H25 | 109.5° | 109.5° |
| C23 | C24 | H26 | 109.5° | 109.5° |
| C24 | C23 | H39 | 109.6° | 109.1° |
| O22 | C21 | C23 | 108.8° | 109.9° |
| O22 | C21 | C19 | 109.0° | 110.3° |
| O22 | C21 | H38 | 109.4° | 108.4° |
| C21 | O22 | H41 | 109.5° | 114.0° |
| C29 | C27 | C25 | 111.9° | 106.8° |
| C29 | C27 | C28 | 108.8° | 107.1° |
| C29 | C27 | C30 | 106.1° | 107.2° |
| C27 | C29 | H4 | 109.5° | 109.5° |
| C27 | C29 | H5 | 109.5° | 109.4° |
| C27 | C29 | H6 | 109.5° | 109.5° |
| C21 | C23 | C25 | 112.1° | 109.4° |
| C23 | C21 | C19 | 114.2° | 111.2° |
| C23 | C21 | H38 | 107.6° | 108.3° |
| C21 | C23 | H39 | 109.6° | 108.4° |
| C23 | C25 | C27 | 121.2° | 124.0° |
| C23 | C25 | O26 | 120.6° | 118.6° |
| C25 | C23 | H39 | 109.3° | 109.2° |
| C21 | C19 | C18 | 110.9° | 111.0° |
| C21 | C19 | C20 | 109.2° | 108.7° |
| C21 | C19 | H22 | 108.9° | 110.5° |
| C19 | C21 | H38 | 107.6° | 108.7° |
| C27 | C25 | O26 | 118.2° | 117.4° |
| C25 | C27 | C28 | 110.3° | 111.0° |
| C25 | C27 | C30 | 108.9° | 110.7° |
| C28 | C27 | C30 | 110.8° | 113.6° |
| C27 | C28 | H1 | 109.5° | 109.5° |
| C27 | C28 | H2 | 109.5° | 109.4° |
| C27 | C28 | H3 | 109.5° | 109.5° |
| C27 | C30 | O31 | 106.5° | 108.6° |
| C27 | C30 | C32 | 111.7° | 115.2° |
| C27 | C30 | H7 | 107.5° | 108.4° |
| C19 | C18 | C17 | 110.0° | 109.9° |
| C18 | C19 | C20 | 109.6° | 108.7° |
| C19 | C18 | H17 | 109.3° | 111.0° |
| C19 | C18 | H18 | 109.4° | 109.3° |
| C18 | C19 | H22 | 109.0° | 110.0° |
| C18 | C17 | C16 | 111.7° | 109.1° |
| C18 | C17 | H13 | 108.9° | 108.9° |
| C18 | C17 | H14 | 108.9° | 109.3° |
| C17 | C18 | H17 | 109.4° | 108.7° |
| C17 | C18 | H18 | 109.3° | 108.8° |
| C19 | C20 | H10 | 109.5° | 109.5° |
| C19 | C20 | H11 | 109.5° | 109.5° |
| C19 | C20 | H12 | 109.5° | 109.5° |
| C20 | C19 | H22 | 109.1° | 107.9° |
| O31 | C30 | C32 | 113.7° | 108.7° |
| O31 | C30 | H7 | 109.7° | 106.7° |
| C30 | O31 | H42 | 109.5° | 114.0° |
| C30 | C32 | C33 | 111.3° | 109.1° |
| C32 | C30 | H7 | 107.6° | 108.9° |
| C30 | C32 | H8 | 109.0° | 109.6° |
| C30 | C32 | H9 | 109.0° | 114.1° |
| C17 | C16 | C14 | 109.3° | 110.7° |
| C16 | C17 | H13 | 108.9° | 109.7° |
| C16 | C17 | H14 | 108.9° | 110.1° |
| C17 | C16 | H15 | 109.5° | 109.0° |
| C17 | C16 | H16 | 109.5° | 109.5° |
| C16 | C14 | O13 | 96.3° | 117.0° |
| C16 | C14 | C12 | 137.8° | 119.3° |
| C16 | C14 | C15 | 107.2° | 115.9° |
| C14 | C16 | H15 | 109.5° | 109.1° |
| C14 | C16 | H16 | 109.5° | 109.8° |
| C32 | C33 | N35 | 117.4° | 117.7° |
| C32 | C33 | O34 | 121.0° | 119.7° |
| C33 | C32 | H8 | 109.0° | 107.9° |
| C33 | C32 | H9 | 109.0° | 106.9° |
| C14 | O13 | C12 | 59.6° | 64.3° |
| O13 | C14 | C12 | 59.8° | 57.6° |
| O13 | C14 | C15 | 111.0° | 116.4° |
| O13 | C12 | C11 | 107.5° | 117.3° |
| O13 | C12 | C14 | 60.6° | 58.0° |
| O13 | C12 | H23 | 112.2° | 117.3° |
| C01 | C02 | C10 | 118.6° | 120.0° |
| C01 | C02 | C03 | 122.7° | 120.0° |
| C02 | C01 | H27 | 109.5° | 109.4° |
| C02 | C01 | H28 | 109.4° | 109.4° |
| C02 | C01 | H29 | 109.5° | 109.5° |
| C33 | N35 | C10 | 119.5° | 118.8° |
| N35 | C33 | O34 | 121.6° | 122.6° |
| C33 | N35 | H40 | 120.3° | 120.4° |
| N35 | C10 | C11 | 112.1° | 109.7° |
| N35 | C10 | C02 | 109.1° | 110.9° |
| N35 | C10 | H35 | 110.3° | 108.8° |
| C10 | N35 | H40 | 120.3° | 120.8° |
| C12 | C11 | C10 | 106.5° | 109.3° |
| C11 | C12 | C14 | 136.7° | 119.4° |
| C11 | C12 | H23 | 110.7° | 115.2° |
| C12 | C11 | H36 | 110.2° | 109.3° |
| C12 | C11 | H37 | 110.2° | 109.7° |
| C11 | C10 | C02 | 106.9° | 110.3° |
| C11 | C10 | H35 | 109.2° | 108.6° |
| C10 | C11 | H36 | 110.2° | 109.3° |
| C10 | C11 | H37 | 110.2° | 109.8° |
| C12 | C14 | C15 | 113.6° | 117.9° |
| C14 | C12 | H23 | 112.2° | 117.6° |
| C14 | C15 | H19 | 109.5° | 109.5° |
| C14 | C15 | H20 | 109.5° | 109.4° |
| C14 | C15 | H21 | 109.5° | 109.4° |
| C10 | C02 | C03 | 118.7° | 120.0° |
| C02 | C10 | H35 | 109.1° | 108.5° |
| C02 | C03 | C04 | 126.0° | 120.0° |
| C02 | C03 | H30 | 117.0° | 120.0° |
| C04 | C05 | S06 | 104.6° | 107.8° |
| C05 | C04 | C03 | 122.2° | 123.0° |
| C05 | C04 | N09 | 116.2° | 114.0° |
| C04 | C05 | H31 | 127.7° | 126.0° |
| C05 | S06 | C07 | 94.8° | 90.5° |
| S06 | C05 | H31 | 127.7° | 126.1° |
| C03 | C04 | N09 | 121.6° | 123.0° |
| C04 | C03 | H30 | 117.0° | 120.0° |
| C04 | N09 | C07 | 116.5° | 117.1° |
| S06 | C07 | N09 | 107.9° | 110.5° |
| S06 | C07 | C08 | 126.0° | 124.8° |
| N09 | C07 | C08 | 126.1° | 124.7° |
| C07 | C08 | H32 | 109.5° | 109.5° |
| C07 | C08 | H33 | 109.4° | 109.4° |
| C07 | C08 | H34 | 109.5° | 109.5° |
| H1 | C28 | H2 | 109.5° | 109.5° |
| H1 | C28 | H3 | 109.4° | 109.5° |
| H2 | C28 | H3 | 109.5° | 109.5° |
| H4 | C29 | H5 | 109.5° | 109.4° |
| H4 | C29 | H6 | 109.4° | 109.5° |
| H5 | C29 | H6 | 109.5° | 109.5° |
| H8 | C32 | H9 | 109.5° | 109.0° |
| H10 | C20 | H11 | 109.5° | 109.5° |
| H10 | C20 | H12 | 109.5° | 109.5° |
| H11 | C20 | H12 | 109.5° | 109.5° |
| H13 | C17 | H14 | 109.5° | 109.7° |
| H15 | C16 | H16 | 109.4° | 108.7° |
| H17 | C18 | H18 | 109.4° | 109.0° |
| H19 | C15 | H20 | 109.5° | 109.4° |
| H19 | C15 | H21 | 109.5° | 109.5° |
| H20 | C15 | H21 | 109.4° | 109.5° |
| H24 | C24 | H25 | 109.5° | 109.5° |
| H24 | C24 | H26 | 109.5° | 109.5° |
| H25 | C24 | H26 | 109.5° | 109.4° |
| H27 | C01 | H28 | 109.5° | 109.5° |
| H27 | C01 | H29 | 109.5° | 109.5° |
| H28 | C01 | H29 | 109.5° | 109.5° |
| H32 | C08 | H33 | 109.5° | 109.5° |
| H32 | C08 | H34 | 109.5° | 109.4° |
| H33 | C08 | H34 | 109.5° | 109.5° |
| H36 | C11 | H37 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C24 | C23 | C21 | O22 | 42.2° | 76.5° |
| C24 | C23 | C21 | C25 | 119.7° | 122.1° |
| C24 | C23 | C21 | H39 | 118.7° | 118.9° |
| C24 | C23 | C25 | H39 | 120.0° | 120.4° |
| C24 | C23 | C21 | C19 | 164.3° | 45.9° |
| C24 | C23 | C25 | C27 | 101.1° | 43.6° |
| C24 | C23 | C25 | O26 | 79.3° | 137.2° |
| C23 | C24 | H24 | H25 | 120.0° | 120.1° |
| C23 | C24 | H24 | H26 | 120.0° | 120.0° |
| C23 | C24 | H25 | H26 | 120.0° | 120.0° |
| C24 | C23 | C21 | H38 | 76.3° | 165.3° |
| O22 | C21 | C23 | C19 | 122.1° | 122.4° |
| O22 | C21 | C23 | H38 | 118.5° | 118.2° |
| O22 | C21 | C23 | C25 | 161.9° | 45.6° |
| O22 | C21 | C19 | H38 | 118.6° | 118.7° |
| O22 | C21 | C19 | C18 | 71.0° | 22.6° |
| O22 | C21 | C19 | C20 | 49.9° | 96.8° |
| O22 | C21 | C19 | H22 | 168.9° | 145.0° |
| O22 | C21 | C23 | H39 | 76.5° | 164.6° |
| C29 | C27 | C25 | C23 | 44.0° | 163.5° |
| C29 | C27 | C25 | C28 | 121.3° | 116.5° |
| C29 | C27 | C25 | C30 | 116.9° | 116.4° |
| C29 | C27 | C25 | O26 | 136.4° | 15.7° |
| C29 | C27 | C28 | C30 | 116.2° | 118.2° |
| C29 | C27 | C30 | O31 | 44.3° | 12.8° |
| C29 | C27 | C30 | C32 | 169.1° | 134.9° |
| C29 | C27 | C28 | H1 | 180.0° | 176.3° |
| C29 | C27 | C28 | H2 | 60.0° | 63.7° |
| C29 | C27 | C28 | H3 | 60.0° | 56.2° |
| C27 | C29 | H4 | H5 | 120.0° | 119.9° |
| C27 | C29 | H4 | H6 | 120.0° | 120.0° |
| C27 | C29 | H5 | H6 | 120.0° | 120.0° |
| C29 | C27 | C30 | H7 | 73.2° | 102.8° |
| C21 | C23 | C25 | H39 | 121.8° | 118.5° |
| C23 | C21 | C19 | H38 | 119.4° | 119.1° |
| C21 | C23 | C25 | C27 | 140.7° | 164.7° |
| C21 | C23 | C25 | O26 | 39.0° | 16.1° |
| C23 | C21 | C19 | C18 | 51.0° | 99.6° |
| C23 | C21 | C19 | C20 | 171.9° | 141.0° |
| C23 | C21 | C19 | H22 | 69.1° | 22.8° |
| C21 | C23 | C24 | H24 | 180.0° | 60.0° |
| C21 | C23 | C24 | H25 | 60.0° | 180.0° |
| C21 | C23 | C24 | H26 | 60.0° | 60.0° |
| C23 | C21 | O22 | H41 | 180.0° | 172.0° |
| C25 | C23 | C21 | C19 | 76.0° | 168.0° |
| C23 | C25 | C27 | O26 | 179.7° | 179.2° |
| C23 | C25 | C27 | C28 | 165.3° | 47.0° |
| C23 | C25 | C27 | C30 | 73.0° | 80.2° |
| C25 | C23 | C24 | H24 | 58.5° | 61.0° |
| C25 | C23 | C24 | H25 | 178.5° | 59.0° |
| C25 | C23 | C24 | H26 | 61.5° | 179.0° |
| C25 | C23 | C21 | H38 | 43.4° | 72.6° |
| C21 | C19 | C18 | C20 | 120.7° | 119.5° |
| C21 | C19 | C18 | H22 | 119.9° | 122.6° |
| C21 | C19 | C18 | C17 | 148.1° | 133.8° |
| C21 | C19 | C20 | H22 | 119.0° | 119.9° |
| C21 | C19 | C20 | H10 | 180.0° | 179.1° |
| C21 | C19 | C20 | H11 | 60.0° | 59.1° |
| C21 | C19 | C20 | H12 | 60.0° | 60.9° |
| C21 | C19 | C18 | H17 | 91.8° | 13.4° |
| C21 | C19 | C18 | H18 | 28.0° | 106.9° |
| C19 | C21 | C23 | H39 | 45.6° | 73.0° |
| C19 | C21 | O22 | H41 | 54.8° | 65.1° |
| C25 | C27 | C28 | C30 | 120.6° | 125.6° |
| C25 | C27 | C30 | O31 | 164.9° | 128.9° |
| C25 | C27 | C30 | C32 | 70.3° | 108.9° |
| C25 | C27 | C28 | H1 | 56.9° | 60.1° |
| C25 | C27 | C28 | H2 | 176.9° | 180.0° |
| C25 | C27 | C28 | H3 | 63.1° | 60.0° |
| C25 | C27 | C29 | H4 | 180.0° | 60.0° |
| C25 | C27 | C29 | H5 | 60.0° | 179.9° |
| C25 | C27 | C29 | H6 | 60.0° | 60.0° |
| C25 | C27 | C30 | H7 | 47.4° | 13.4° |
| C27 | C25 | C23 | H39 | 18.9° | 76.8° |
| O26 | C25 | C27 | C28 | 15.1° | 132.2° |
| O26 | C25 | C27 | C30 | 106.7° | 100.6° |
| O26 | C25 | C23 | H39 | 160.8° | 102.4° |
| C28 | C27 | C30 | O31 | 73.6° | 105.3° |
| C28 | C27 | C30 | C32 | 51.2° | 16.8° |
| C27 | C28 | H1 | H2 | 120.0° | 119.9° |
| C27 | C28 | H1 | H3 | 120.0° | 120.0° |
| C27 | C28 | H2 | H3 | 120.0° | 120.0° |
| C28 | C27 | C29 | H4 | 57.8° | 59.0° |
| C28 | C27 | C29 | H5 | 177.8° | 60.9° |
| C28 | C27 | C29 | H6 | 62.2° | 179.1° |
| C28 | C27 | C30 | H7 | 168.9° | 139.1° |
| C27 | C30 | O31 | C32 | 123.5° | 126.0° |
| C27 | C30 | O31 | H7 | 116.0° | 116.6° |
| C27 | C30 | C32 | H7 | 117.7° | 122.0° |
| C27 | C30 | C32 | C33 | 171.5° | 139.6° |
| C30 | C27 | C28 | H1 | 63.8° | 65.5° |
| C30 | C27 | C28 | H2 | 56.2° | 54.5° |
| C30 | C27 | C28 | H3 | 176.3° | 174.4° |
| C30 | C27 | C29 | H4 | 61.4° | 178.7° |
| C30 | C27 | C29 | H5 | 58.6° | 61.4° |
| C30 | C27 | C29 | H6 | 178.6° | 58.7° |
| C27 | C30 | C32 | H8 | 51.2° | 102.4° |
| C27 | C30 | C32 | H9 | 68.2° | 20.1° |
| C27 | C30 | O31 | H42 | 180.0° | 180.0° |
| C19 | C18 | C17 | H17 | 120.1° | 121.7° |
| C19 | C18 | C17 | H18 | 120.1° | 119.6° |
| C18 | C19 | C20 | H22 | 119.3° | 119.2° |
| C19 | C18 | C17 | C16 | 121.3° | 156.2° |
| C18 | C19 | C20 | H10 | 58.3° | 60.0° |
| C18 | C19 | C20 | H11 | 178.3° | 180.0° |
| C18 | C19 | C20 | H12 | 61.7° | 60.0° |
| C19 | C18 | C17 | H13 | 118.3° | 84.2° |
| C19 | C18 | C17 | H14 | 1.0° | 35.7° |
| C19 | C18 | H17 | H18 | 119.8° | 120.4° |
| C18 | C19 | C21 | H38 | 170.4° | 141.3° |
| C17 | C18 | C19 | C20 | 91.2° | 106.8° |
| C18 | C17 | C16 | H13 | 120.3° | 119.2° |
| C18 | C17 | C16 | H14 | 120.3° | 120.0° |
| C18 | C17 | C16 | C14 | 177.8° | 158.5° |
| C18 | C17 | H13 | H14 | 119.0° | 119.6° |
| C18 | C17 | C16 | H15 | 62.2° | 81.5° |
| C18 | C17 | C16 | H16 | 57.8° | 37.3° |
| C17 | C18 | H17 | H18 | 119.8° | 118.5° |
| C17 | C18 | C19 | H22 | 28.2° | 11.1° |
| C19 | C20 | H10 | H11 | 120.0° | 120.0° |
| C19 | C20 | H10 | H12 | 120.0° | 120.0° |
| C19 | C20 | H11 | H12 | 120.0° | 120.0° |
| C20 | C19 | C18 | H17 | 28.9° | 132.9° |
| C20 | C19 | C18 | H18 | 148.7° | 12.6° |
| C20 | C19 | C21 | H38 | 68.7° | 21.8° |
| O31 | C30 | C32 | H7 | 121.7° | 115.9° |
| O31 | C30 | C32 | C33 | 50.9° | 98.3° |
| O31 | C30 | C32 | H8 | 69.4° | 19.7° |
| O31 | C30 | C32 | H9 | 171.2° | 142.2° |
| C30 | C32 | C33 | H8 | 120.3° | 119.0° |
| C30 | C32 | C33 | H9 | 120.3° | 123.9° |
| C30 | C32 | C33 | N35 | 12.3° | 166.8° |
| C30 | C32 | C33 | O34 | 166.6° | 12.9° |
| C30 | C32 | H8 | H9 | 119.1° | 125.6° |
| C32 | C30 | O31 | H42 | 56.5° | 54.0° |
| C17 | C16 | C14 | H15 | 120.0° | 119.9° |
| C17 | C16 | C14 | H16 | 120.0° | 121.1° |
| C17 | C16 | C14 | O13 | 115.6° | 180.0° |
| C17 | C16 | C14 | C12 | 64.7° | 113.8° |
| C17 | C16 | C14 | C15 | 130.1° | 36.6° |
| C16 | C17 | H13 | H14 | 119.0° | 121.1° |
| C17 | C16 | H15 | H16 | 120.1° | 119.3° |
| C16 | C17 | C18 | H17 | 1.2° | 34.4° |
| C16 | C17 | C18 | H18 | 118.6° | 84.2° |
| C16 | C14 | O13 | C12 | 143.0° | 109.2° |
| C16 | C14 | O13 | C15 | 111.2° | 143.2° |
| C16 | C14 | C12 | C11 | 21.5° | 0.5° |
| C16 | C14 | C12 | C15 | 164.5° | 149.8° |
| C14 | C16 | C17 | H13 | 57.5° | 82.3° |
| C14 | C16 | C17 | H14 | 61.9° | 38.5° |
| C14 | C16 | H15 | H16 | 120.1° | 119.7° |
| C16 | C14 | C15 | H19 | 180.0° | 34.4° |
| C16 | C14 | C15 | H20 | 60.0° | 154.4° |
| C16 | C14 | C15 | H21 | 60.0° | 85.6° |
| C16 | C14 | C12 | H23 | 166.9° | 148.5° |
| C32 | C33 | N35 | O34 | 178.9° | 179.6° |
| C32 | C33 | N35 | C10 | 177.9° | 173.5° |
| C33 | C32 | C30 | H7 | 70.8° | 17.6° |
| C33 | C32 | H8 | H9 | 119.1° | 115.7° |
| C32 | C33 | N35 | H40 | 2.0° | 6.3° |
| O13 | C14 | C12 | C11 | 84.6° | 105.6° |
| O13 | C14 | C12 | C15 | 101.4° | 105.1° |
| O13 | C14 | C16 | H15 | 124.5° | 60.0° |
| O13 | C14 | C16 | H16 | 4.4° | 59.0° |
| O13 | C14 | C15 | H19 | 75.9° | 109.1° |
| O13 | C14 | C15 | H20 | 164.0° | 10.8° |
| O13 | C14 | C15 | H21 | 44.1° | 130.8° |
| C14 | O13 | C12 | H23 | 103.8° | 107.0° |
| O13 | C12 | C11 | H23 | 122.9° | 144.5° |
| O13 | C12 | C11 | C10 | 145.4° | 129.6° |
| O13 | C12 | C11 | H36 | 95.1° | 10.0° |
| O13 | C12 | C11 | H37 | 25.9° | 110.0° |
| C01 | C02 | C10 | N35 | 58.3° | 177.9° |
| C01 | C02 | C10 | C11 | 63.2° | 60.4° |
| C01 | C02 | C10 | C03 | 179.7° | 180.0° |
| C01 | C02 | C03 | C04 | 1.2° | 6.3° |
| C02 | C01 | H27 | H28 | 120.0° | 120.0° |
| C02 | C01 | H27 | H29 | 120.0° | 120.0° |
| C02 | C01 | H28 | H29 | 120.0° | 120.0° |
| C01 | C02 | C03 | H30 | 178.9° | 173.8° |
| C01 | C02 | C10 | H35 | 178.9° | 58.4° |
| C33 | N35 | C10 | H40 | 180.0° | 179.8° |
| C33 | N35 | C10 | C11 | 147.9° | 56.8° |
| C33 | N35 | C10 | C02 | 93.9° | 65.3° |
| N35 | C33 | C32 | H8 | 132.6° | 74.2° |
| N35 | C33 | C32 | H9 | 108.0° | 42.9° |
| C33 | N35 | C10 | H35 | 26.0° | 175.4° |
| N35 | C10 | C11 | C12 | 89.3° | 112.3° |
| N35 | C10 | C11 | C02 | 119.5° | 122.4° |
| N35 | C10 | C11 | H35 | 122.6° | 118.7° |
| C10 | N35 | C33 | O34 | 1.0° | 6.1° |
| N35 | C10 | C02 | H35 | 120.6° | 119.4° |
| N35 | C10 | C02 | C03 | 122.0° | 2.1° |
| N35 | C10 | C11 | H36 | 151.2° | 128.1° |
| N35 | C10 | C11 | H37 | 30.2° | 8.0° |
| C12 | C11 | C10 | H36 | 119.5° | 119.6° |
| C12 | C11 | C10 | H37 | 119.6° | 120.3° |
| C11 | C12 | C14 | H23 | 171.6° | 147.9° |
| C11 | C12 | C14 | C15 | 173.9° | 149.3° |
| C12 | C11 | C10 | C02 | 151.1° | 125.2° |
| C12 | C11 | C10 | H35 | 33.2° | 6.4° |
| C12 | C11 | H36 | H37 | 121.4° | 120.1° |
| C10 | C11 | C12 | C14 | 79.9° | 163.5° |
| C11 | C10 | C02 | H35 | 117.9° | 118.8° |
| C11 | C10 | C02 | C03 | 116.5° | 119.6° |
| C10 | C11 | C12 | H23 | 91.7° | 14.9° |
| C10 | C11 | H36 | H37 | 121.4° | 120.3° |
| C11 | C10 | N35 | H40 | 32.1° | 123.1° |
| C12 | C14 | C16 | H15 | 175.3° | 126.3° |
| C12 | C14 | C16 | H16 | 55.3° | 7.3° |
| C12 | C14 | C15 | H19 | 10.8° | 174.7° |
| C12 | C14 | C15 | H20 | 130.8° | 54.7° |
| C12 | C14 | C15 | H21 | 109.2° | 65.2° |
| C14 | C12 | C11 | H36 | 160.5° | 76.9° |
| C14 | C12 | C11 | H37 | 39.6° | 43.2° |
| C15 | C14 | C16 | H15 | 10.1° | 83.3° |
| C15 | C14 | C16 | H16 | 109.9° | 157.7° |
| C14 | C15 | H19 | H20 | 120.0° | 120.0° |
| C14 | C15 | H19 | H21 | 120.0° | 120.0° |
| C14 | C15 | H20 | H21 | 120.0° | 119.9° |
| C15 | C14 | C12 | H23 | 2.4° | 1.4° |
| O34 | C33 | C32 | H8 | 46.4° | 106.2° |
| O34 | C33 | C32 | H9 | 73.1° | 136.8° |
| O34 | C33 | N35 | H40 | 179.0° | 174.0° |
| C10 | C02 | C03 | C04 | 178.5° | 173.7° |
| C10 | C02 | C01 | H27 | 180.0° | 124.8° |
| C10 | C02 | C01 | H28 | 60.0° | 4.8° |
| C10 | C02 | C01 | H29 | 60.0° | 115.2° |
| C10 | C02 | C03 | H30 | 1.4° | 6.2° |
| C02 | C10 | C11 | H36 | 31.6° | 5.7° |
| C02 | C10 | C11 | H37 | 89.3° | 114.5° |
| C02 | C10 | N35 | H40 | 86.1° | 114.9° |
| C02 | C03 | C04 | C05 | 46.7° | 175.2° |
| C02 | C03 | C04 | H30 | 180.0° | 179.9° |
| C02 | C03 | C04 | N09 | 135.5° | 5.1° |
| C03 | C02 | C01 | H27 | 0.3° | 55.2° |
| C03 | C02 | C01 | H28 | 119.7° | 175.2° |
| C03 | C02 | C01 | H29 | 120.3° | 64.8° |
| C03 | C02 | C10 | H35 | 1.4° | 121.6° |
| C04 | C05 | S06 | H31 | 180.0° | 180.0° |
| C05 | C04 | C03 | N09 | 177.8° | 179.7° |
| C04 | C05 | S06 | C07 | 0.9° | 0.2° |
| C05 | C04 | N09 | C07 | 0.0° | 0.2° |
| C05 | C04 | C03 | H30 | 133.2° | 4.7° |
| S06 | C05 | C04 | C03 | 178.6° | 180.0° |
| S06 | C05 | C04 | N09 | 0.7° | 0.3° |
| C05 | S06 | C07 | N09 | 0.9° | 0.1° |
| C05 | S06 | C07 | C08 | 179.1° | 179.9° |
| C03 | C04 | N09 | C07 | 177.9° | 180.0° |
| C03 | C04 | C05 | H31 | 1.4° | 0.1° |
| C04 | N09 | C07 | S06 | 0.7° | 0.1° |
| C04 | N09 | C07 | C08 | 178.9° | 180.0° |
| N09 | C04 | C03 | H30 | 44.6° | 175.0° |
| N09 | C04 | C05 | H31 | 179.3° | 179.8° |
| S06 | C07 | N09 | C08 | 178.2° | 179.9° |
| C07 | S06 | C05 | H31 | 179.1° | 179.9° |
| S06 | C07 | C08 | H32 | 0.0° | 90.1° |
| S06 | C07 | C08 | H33 | 120.0° | 29.9° |
| S06 | C07 | C08 | H34 | 120.0° | 149.9° |
| N09 | C07 | C08 | H32 | 177.9° | 90.0° |
| N09 | C07 | C08 | H33 | 57.9° | 150.0° |
| N09 | C07 | C08 | H34 | 62.1° | 30.0° |
| C07 | C08 | H32 | H33 | 120.0° | 120.0° |
| C07 | C08 | H32 | H34 | 120.0° | 120.0° |
| C07 | C08 | H33 | H34 | 120.0° | 120.0° |
| H1 | C28 | H2 | H3 | 120.0° | 120.1° |
| H4 | C29 | H5 | H6 | 120.0° | 120.0° |
| H7 | C30 | C32 | H8 | 168.9° | 135.6° |
| H7 | C30 | C32 | H9 | 49.5° | 101.9° |
| H7 | C30 | O31 | H42 | 64.0° | 63.4° |
| H10 | C20 | H11 | H12 | 120.0° | 120.0° |
| H10 | C20 | C19 | H22 | 61.0° | 59.2° |
| H11 | C20 | C19 | H22 | 59.0° | 60.8° |
| H12 | C20 | C19 | H22 | 179.0° | 179.2° |
| H13 | C17 | C16 | H15 | 177.5° | 37.7° |
| H13 | C17 | C16 | H16 | 62.5° | 156.4° |
| H13 | C17 | C18 | H17 | 121.6° | 154.1° |
| H13 | C17 | C18 | H18 | 1.8° | 35.4° |
| H14 | C17 | C16 | H15 | 58.1° | 158.5° |
| H14 | C17 | C16 | H16 | 178.1° | 82.7° |
| H14 | C17 | C18 | H17 | 119.1° | 86.1° |
| H14 | C17 | C18 | H18 | 121.1° | 155.3° |
| H17 | C18 | C19 | H22 | 148.3° | 109.2° |
| H18 | C18 | C19 | H22 | 91.9° | 130.5° |
| H19 | C15 | H20 | H21 | 120.0° | 120.0° |
| H22 | C19 | C21 | H38 | 50.3° | 96.4° |
| H23 | C12 | C11 | H36 | 27.8° | 134.5° |
| H23 | C12 | C11 | H37 | 148.7° | 105.5° |
| H24 | C24 | H25 | H26 | 120.0° | 120.0° |
| H24 | C24 | C23 | H39 | 61.3° | 178.5° |
| H25 | C24 | C23 | H39 | 58.7° | 61.4° |
| H26 | C24 | C23 | H39 | 178.7° | 58.5° |
| H27 | C01 | H28 | H29 | 120.0° | 120.0° |
| H32 | C08 | H33 | H34 | 120.0° | 120.0° |
| H35 | C10 | C11 | H36 | 86.3° | 113.2° |
| H35 | C10 | C11 | H37 | 152.8° | 126.7° |
| H35 | C10 | N35 | H40 | 154.0° | 4.4° |
| H38 | C21 | C23 | H39 | 165.0° | 46.3° |
| H38 | C21 | O22 | H41 | 62.6° | 53.8° |
