OZM
Bonds
| First atom | Second atom | Bond order type | Distance (experimental model) | Distance (ideal model) | Properties |
| C03 | C02 | sing | 1.51Å | 1.56Å | |
| C03 | C04 | sing | 1.51Å | 1.45Å | |
| O20 | C02 | doub | 1.21Å | 1.29Å | |
| C02 | O01 | sing | 1.34Å | 1.29Å | |
| C04 | C05 | doub | 1.34Å | 1.45Å | Aromatic |
| C04 | C19 | sing | 1.47Å | 1.51Å | Aromatic |
| C05 | O06 | sing | 1.34Å | 1.36Å | Aromatic |
| C19 | C18 | doub | 1.39Å | 1.43Å | Aromatic |
| C19 | C07 | sing | 1.40Å | 1.41Å | Aromatic |
| C18 | C17 | sing | 1.38Å | 1.43Å | Aromatic |
| O06 | C07 | sing | 1.35Å | 1.34Å | Aromatic |
| C07 | C08 | doub | 1.39Å | 1.42Å | Aromatic |
| C17 | C09 | doub | 1.39Å | 1.44Å | Aromatic |
| C15 | C16 | doub | 1.38Å | 1.42Å | Aromatic |
| C15 | C14 | sing | 1.38Å | 1.41Å | Aromatic |
| C16 | C11 | sing | 1.38Å | 1.41Å | Aromatic |
| C14 | C13 | doub | 1.38Å | 1.41Å | Aromatic |
| C08 | C09 | sing | 1.38Å | 1.41Å | Aromatic |
| C09 | C10 | sing | 1.51Å | 1.56Å | |
| C11 | C10 | sing | 1.51Å | 1.54Å | |
| C11 | C12 | doub | 1.38Å | 1.41Å | Aromatic |
| C13 | C12 | sing | 1.38Å | 1.42Å | Aromatic |
| C10 | H102 | sing | 1.09Å | 1.10Å | |
| C10 | H101 | sing | 1.09Å | 1.10Å | |
| C13 | H131 | sing | 1.08Å | 1.08Å | |
| C15 | H151 | sing | 1.08Å | 1.08Å | |
| C17 | H171 | sing | 1.08Å | 1.08Å | |
| C03 | H031 | sing | 1.09Å | 1.10Å | |
| C03 | H032 | sing | 1.09Å | 1.10Å | |
| C05 | H051 | sing | 1.08Å | 1.08Å | |
| C08 | H081 | sing | 1.08Å | 1.08Å | |
| C12 | H121 | sing | 1.08Å | 1.08Å | |
| C14 | H141 | sing | 1.08Å | 1.08Å | |
| C16 | H161 | sing | 1.08Å | 1.08Å | |
| C18 | H181 | sing | 1.08Å | 1.08Å | |
| O01 | H1 | sing | 0.97Å | 0.95Å |
Angles
| First atom | Second atom | Third atom | Angle (experimental model) | Angle (ideal model) |
| C02 | C03 | C04 | 114.7° | 109.5° |
| C03 | C02 | O20 | 121.0° | 120.0° |
| C03 | C02 | O01 | 120.1° | 120.0° |
| C02 | C03 | H031 | 108.1° | 109.5° |
| C02 | C03 | H032 | 108.1° | 109.5° |
| C03 | C04 | C05 | 125.6° | 126.9° |
| C03 | C04 | C19 | 132.3° | 126.9° |
| C04 | C03 | H031 | 108.2° | 109.5° |
| C04 | C03 | H032 | 108.1° | 109.5° |
| O20 | C02 | O01 | 119.0° | 120.0° |
| C02 | O01 | H1 | 109.5° | 117.0° |
| C05 | C04 | C19 | 102.1° | 106.2° |
| C04 | C05 | O06 | 108.7° | 110.2° |
| C04 | C05 | H051 | 125.6° | 124.9° |
| C04 | C19 | C18 | 132.4° | 134.3° |
| C04 | C19 | C07 | 108.5° | 105.5° |
| C05 | O06 | C07 | 113.8° | 110.9° |
| O06 | C05 | H051 | 125.6° | 124.9° |
| C18 | C19 | C07 | 119.1° | 120.1° |
| C19 | C18 | C17 | 119.8° | 119.6° |
| C19 | C18 | H181 | 120.1° | 120.2° |
| C19 | C07 | O06 | 106.9° | 107.2° |
| C19 | C07 | C08 | 120.9° | 119.4° |
| C18 | C17 | C09 | 120.6° | 120.3° |
| C18 | C17 | H171 | 119.7° | 119.8° |
| C17 | C18 | H181 | 120.1° | 120.2° |
| O06 | C07 | C08 | 132.2° | 133.4° |
| C07 | C08 | C09 | 121.0° | 119.9° |
| C07 | C08 | H081 | 119.5° | 120.1° |
| C17 | C09 | C08 | 118.6° | 120.7° |
| C17 | C09 | C10 | 120.2° | 119.7° |
| C09 | C17 | H171 | 119.7° | 119.9° |
| C16 | C15 | C14 | 119.9° | 120.0° |
| C15 | C16 | C11 | 121.1° | 120.0° |
| C16 | C15 | H151 | 120.0° | 120.0° |
| C15 | C16 | H161 | 119.5° | 120.0° |
| C15 | C14 | C13 | 119.5° | 120.1° |
| C14 | C15 | H151 | 120.0° | 120.1° |
| C15 | C14 | H141 | 120.2° | 120.0° |
| C16 | C11 | C10 | 120.3° | 120.0° |
| C16 | C11 | C12 | 118.6° | 120.0° |
| C11 | C16 | H161 | 119.5° | 120.0° |
| C14 | C13 | C12 | 120.0° | 120.0° |
| C14 | C13 | H131 | 120.0° | 120.0° |
| C13 | C14 | H141 | 120.3° | 120.0° |
| C08 | C09 | C10 | 121.2° | 119.6° |
| C09 | C08 | H081 | 119.5° | 120.0° |
| C09 | C10 | C11 | 114.0° | 109.5° |
| C09 | C10 | H102 | 108.3° | 109.5° |
| C09 | C10 | H101 | 108.3° | 109.5° |
| C10 | C11 | C12 | 121.0° | 120.0° |
| C11 | C10 | H102 | 108.3° | 109.4° |
| C11 | C10 | H101 | 108.3° | 109.5° |
| C11 | C12 | C13 | 120.8° | 120.0° |
| C11 | C12 | H121 | 119.6° | 120.0° |
| C12 | C13 | H131 | 120.0° | 120.0° |
| C13 | C12 | H121 | 119.6° | 120.0° |
| H102 | C10 | H101 | 109.5° | 109.5° |
| H031 | C03 | H032 | 109.5° | 109.5° |
Dihedrals
| First atom | Second atom | Third atom | Fourth atom | Torsion (experimental model) | Torsion (ideal model) |
| C02 | C03 | C04 | H031 | 120.8° | 120.0° |
| C02 | C03 | C04 | H032 | 120.8° | 120.0° |
| C03 | C02 | O20 | O01 | 178.1° | 180.0° |
| C02 | C03 | C04 | C05 | 115.3° | 95.0° |
| C02 | C03 | C04 | C19 | 61.6° | 85.0° |
| C02 | C03 | H031 | H032 | 117.6° | 120.0° |
| C03 | C02 | O01 | H1 | 178.1° | 180.0° |
| C04 | C03 | C02 | O20 | 98.8° | 0.0° |
| C04 | C03 | C02 | O01 | 79.3° | 180.0° |
| C03 | C04 | C05 | C19 | 177.6° | 180.0° |
| C03 | C04 | C05 | O06 | 178.6° | 180.0° |
| C03 | C04 | C19 | C18 | 2.3° | 0.1° |
| C03 | C04 | C19 | C07 | 178.4° | 180.0° |
| C04 | C03 | H031 | H032 | 117.6° | 120.0° |
| C03 | C04 | C05 | H051 | 1.4° | 0.0° |
| O20 | C02 | C03 | H031 | 22.0° | 120.0° |
| O20 | C02 | C03 | H032 | 140.4° | 120.0° |
| O20 | C02 | O01 | H1 | 0.0° | 0.0° |
| O01 | C02 | C03 | H031 | 159.9° | 60.0° |
| O01 | C02 | C03 | H032 | 41.5° | 60.0° |
| C04 | C05 | O06 | H051 | 180.0° | 180.0° |
| C05 | C04 | C19 | C18 | 179.7° | 180.0° |
| C05 | C04 | C19 | C07 | 0.9° | 0.0° |
| C04 | C05 | O06 | C07 | 0.7° | 0.0° |
| C05 | C04 | C03 | H031 | 124.0° | 145.0° |
| C05 | C04 | C03 | H032 | 5.5° | 25.0° |
| C19 | C04 | C05 | O06 | 1.0° | 0.0° |
| C04 | C19 | C18 | C07 | 179.3° | 179.9° |
| C04 | C19 | C18 | C17 | 179.4° | 180.0° |
| C04 | C19 | C07 | O06 | 0.6° | 0.0° |
| C04 | C19 | C07 | C08 | 179.5° | 179.7° |
| C19 | C04 | C03 | H031 | 59.1° | 35.0° |
| C19 | C04 | C03 | H032 | 177.6° | 155.0° |
| C19 | C04 | C05 | H051 | 179.0° | 180.0° |
| C04 | C19 | C18 | H181 | 0.7° | 0.1° |
| C05 | O06 | C07 | C19 | 0.1° | 0.0° |
| C05 | O06 | C07 | C08 | 179.9° | 179.7° |
| C19 | C18 | C17 | H181 | 180.0° | 179.9° |
| C18 | C19 | C07 | O06 | 180.0° | 180.0° |
| C18 | C19 | C07 | C08 | 0.0° | 0.2° |
| C19 | C18 | C17 | C09 | 0.2° | 0.1° |
| C19 | C18 | C17 | H171 | 179.8° | 179.7° |
| C07 | C19 | C18 | C17 | 0.1° | 0.0° |
| C19 | C07 | O06 | C08 | 180.0° | 179.7° |
| C19 | C07 | C08 | C09 | 0.4° | 0.5° |
| C19 | C07 | C08 | H081 | 179.6° | 180.0° |
| C07 | C19 | C18 | H181 | 180.0° | 179.9° |
| C18 | C17 | C09 | H171 | 180.0° | 179.8° |
| C18 | C17 | C09 | C08 | 0.6° | 0.2° |
| C18 | C17 | C09 | C10 | 179.7° | 179.8° |
| O06 | C07 | C08 | C09 | 179.6° | 179.9° |
| C07 | O06 | C05 | H051 | 179.3° | 180.0° |
| O06 | C07 | C08 | H081 | 0.4° | 0.4° |
| C07 | C08 | C09 | C17 | 0.6° | 0.5° |
| C07 | C08 | C09 | H081 | 180.0° | 179.4° |
| C07 | C08 | C09 | C10 | 179.7° | 179.5° |
| C17 | C09 | C08 | C10 | 179.1° | 180.0° |
| C17 | C09 | C10 | C11 | 50.9° | 90.0° |
| C17 | C09 | C10 | H102 | 171.6° | 150.0° |
| C17 | C09 | C10 | H101 | 69.8° | 30.0° |
| C17 | C09 | C08 | H081 | 179.4° | 180.0° |
| C09 | C17 | C18 | H181 | 179.8° | 180.0° |
| C16 | C15 | C14 | H151 | 180.0° | 179.7° |
| C15 | C16 | C11 | H161 | 180.0° | 179.7° |
| C16 | C15 | C14 | C13 | 0.0° | 0.0° |
| C15 | C16 | C11 | C10 | 179.7° | 180.0° |
| C15 | C16 | C11 | C12 | 0.7° | 0.6° |
| C16 | C15 | C14 | H141 | 180.0° | 180.0° |
| C14 | C15 | C16 | C11 | 0.3° | 0.3° |
| C15 | C14 | C13 | H141 | 180.0° | 179.9° |
| C15 | C14 | C13 | C12 | 0.0° | 0.0° |
| C15 | C14 | C13 | H131 | 180.0° | 179.7° |
| C14 | C15 | C16 | H161 | 179.7° | 180.0° |
| C16 | C11 | C10 | C09 | 55.6° | 89.4° |
| C16 | C11 | C10 | C12 | 179.0° | 179.5° |
| C16 | C11 | C12 | C13 | 0.7° | 0.6° |
| C16 | C11 | C10 | H102 | 65.1° | 150.5° |
| C16 | C11 | C10 | H101 | 176.3° | 30.6° |
| C11 | C16 | C15 | H151 | 179.7° | 180.0° |
| C16 | C11 | C12 | H121 | 179.3° | 179.5° |
| C14 | C13 | C12 | C11 | 0.4° | 0.3° |
| C14 | C13 | C12 | H131 | 180.0° | 179.7° |
| C13 | C14 | C15 | H151 | 180.0° | 179.7° |
| C14 | C13 | C12 | H121 | 179.6° | 179.8° |
| C08 | C09 | C10 | C11 | 128.2° | 90.0° |
| C08 | C09 | C10 | H102 | 7.5° | 29.9° |
| C08 | C09 | C10 | H101 | 111.1° | 150.0° |
| C08 | C09 | C17 | H171 | 179.4° | 180.0° |
| C09 | C10 | C11 | H102 | 120.7° | 120.0° |
| C09 | C10 | C11 | H101 | 120.7° | 120.0° |
| C09 | C10 | C11 | C12 | 123.4° | 90.0° |
| C09 | C10 | H102 | H101 | 117.9° | 120.0° |
| C10 | C09 | C17 | H171 | 0.3° | 0.0° |
| C10 | C09 | C08 | H081 | 0.2° | 0.1° |
| C10 | C11 | C12 | C13 | 179.7° | 180.0° |
| C11 | C10 | H102 | H101 | 117.9° | 120.0° |
| C10 | C11 | C12 | H121 | 0.3° | 0.0° |
| C10 | C11 | C16 | H161 | 0.3° | 0.3° |
| C11 | C12 | C13 | H121 | 180.0° | 180.0° |
| C12 | C11 | C10 | H102 | 115.9° | 30.0° |
| C12 | C11 | C10 | H101 | 2.8° | 150.0° |
| C11 | C12 | C13 | H131 | 179.6° | 180.0° |
| C12 | C11 | C16 | H161 | 179.3° | 179.7° |
| C12 | C13 | C14 | H141 | 180.0° | 180.0° |
| H131 | C13 | C12 | H121 | 0.4° | 0.1° |
| H131 | C13 | C14 | H141 | 0.0° | 0.3° |
| H151 | C15 | C14 | H141 | 0.0° | 0.2° |
| H151 | C15 | C16 | H161 | 0.3° | 0.3° |
| H171 | C17 | C18 | H181 | 0.2° | 0.2° |
